4-(4-methylphenyl)-2-[(3,4,5-trimethoxyphenyl)carbonylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-(4-methylphenyl)-2-[(3,4,5-trimethoxyphenyl)carbonylamino]thiophene-3-carboxylic acid Openeye Name: 4-(p-tolyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylic acid CAS Name: 4-(4-methylphenyl)-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(4-methylphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]thiophene-3-carboxylic acid Traditional Name: 4-(p-tolyl)-2-[(3,4,5-trimethoxybenzoyl)amino]-3-thenoic acid Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C(=O)O)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H21NO6S/c1-12-5-7-13(8-6-12)15-11-30-21(18(15)22(25)26)23-20(24)14-9-16(27-2)19(29-4)17(10-14)28-3/h5-11H,1-4H3,(H,23,24)(H,25,26)