Basic information
- Standard SMILES
Cc1cc(C#N)sc1-c1ccc2c(c1)C(C)(C)OC(=O)N2- InChIKey
FUMWUTSVOOBPCJ-UHFFFAOYSA-N- Molecular formula
- C16H14N2O2S
- Average molar mass
- 298.4 g/mol
Names & identifiers
- Preferred name
- 5-(4,4-dimethyl-2-oxo-1,4-dihydro-2H-3,1-benzoxazin-6-yl)-4-methylthiophene-2-carbonitrile
- IUPAC
- 5-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-4-methylthiophene-2-carbonitrile
Names & synonyms
SCHEMBL3870568FUMWUTSVOOBPCJ-UHFFFAOYSA-N5-(4, 4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo [d] [1,3]oxazin-6-yl)-4-methyl-thiophene2-carbonitrile5-(4, 4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-4-methyl-thiophene-2-carbonitrile5-(4, 4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-4-methyl-thiophene2-carbonitrile5-(4,4-dimethyl-2-oxo-1,4-dihydro-2H-3,1-benzoxazin-6-yl)-4-methylthiophene-2-carbonitile5-(4,4-dimethyl-2-oxo-1,4-dihydro-2H-3,1-benzoxazin-6-yl)-4-methylthiophene-2-carbonitrile5-(4,4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-4-methyl-thiophene-2-carbonitrile5-(4,4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-4-methylthiophene-2-carbonitrile5-(4. 4-Dimethyl-2-oxo-1. 4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-4-methyl-thiophene-2-carbonitrile
Database identifiers
- PubChem CID
- 9814768
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 90.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 484
Related reactions
18 records
Linked notes
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