2-(2-Chloro-5-methylpyrimidin-4-yl)-benzo[b]thiophene-4-carboxylic acid [bis-(4-methoxyphenyl)-methyl]-amide

HCID 86625359

Basic information

Standard SMILES: COc1ccc(C(NC(=O)c2cccc3sc(-c4nc(Cl)ncc4C)cc23)c2ccc(OC)cc2)cc1
InChIKey: KHXGPSURRKQMGG-UHFFFAOYSA-N
Molecular formula: C29H24ClN3O3S
Average molar mass: 530 g/mol
Monoisotopic mass: 529.1226905

Preferred name: 2-(2-Chloro-5-methylpyrimidin-4-yl)-benzo[b]thiophene-4-carboxylic acid [bis-(4-methoxyphenyl)-methyl]-amide
IUPAC: N-[bis(4-methoxyphenyl)methyl]-2-(2-chloro-5-methylpyrimidin-4-yl)-1-benzothiophene-4-carboxamide

KHXGPSURRKQMGG-UHFFFAOYSA-N2-(2-chloro-5-methylpyrimidin-4-yl)-benzo[b]thiophene-4-carboxylic acid [bis-(4-methoxyphenyl)-methyl]-amide

5 records

HRID 662236As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 938006As reactantValidation data from https://doi.org/10.1039/C8SC04228D

HRID 1986211As reactantuspto-grants-2009_06

HRID 1986309As productuspto-grants-2009_06

HRID 1986310As reactantuspto-grants-2009_06

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Standard SMILES: COc1ccc(C(NC(=O)c2cccc3sc(-c4nc(Cl)ncc4C)cc23)c2ccc(OC)cc2)cc1
InChIKey: KHXGPSURRKQMGG-UHFFFAOYSA-N
Molecular formula: C29H24ClN3O3S
Average molar mass: 530 g/mol
Monoisotopic mass: 529.1226905

Preferred name: 2-(2-Chloro-5-methylpyrimidin-4-yl)-benzo[b]thiophene-4-carboxylic acid [bis-(4-methoxyphenyl)-methyl]-amide
IUPAC: N-[bis(4-methoxyphenyl)methyl]-2-(2-chloro-5-methylpyrimidin-4-yl)-1-benzothiophene-4-carboxamide