Basic information
- Standard SMILES
CC(CN1CCCC1)N1c2ccccc2Sc2ccc(C(=O)NCC3CCC3)cc21.O=C(O)/C=C/C(=O)O- InChIKey
RLXRDZGYIJFYCG-WLHGVMLRSA-N- Molecular formula
- C29H35N3O5S
- Average molar mass
- 537.7 g/mol
Names & identifiers
- Preferred name
- N-Cyclobutylmethyl-10-[1-(1-pyrrolidinyl)-2-propyl]-2-phenothiazinecarboxamide fumarate
- IUPAC
- (E)-but-2-enedioic acid;N-(cyclobutylmethyl)-10-(1-pyrrolidin-1-ylpropan-2-yl)phenothiazine-2-carboxamide
Names & synonyms
SCHEMBL9759433RLXRDZGYIJFYCG-WLHGVMLRSA-NN-Cyclobutylmethyl-10-[1-(1-pyrrolidinyl)-2-propyl]-2-phenothiazinecarboxamide fumarate
Database identifiers
- PubChem CID
- 20074895
Properties
Computed structural properties
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 710
Related reactions
1 records
Compound notes
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