3-[[3,5-bis(chloranyl)phenyl]carbonyl-propan-2-yl-amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[3,5-bis(chloranyl)phenyl]carbonyl-propan-2-yl-amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(3,5-dichlorobenzoyl)-isopropyl-amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[(3,5-dichlorophenyl)-oxomethyl]-propan-2-ylamino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(3,5-dichlorobenzoyl)-propan-2-ylamino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(3,5-dichlorobenzoyl)-isopropyl-amino]-5-phenyl-2-thenoic acid Formula: C21H17Cl2NO3S MolecularWeight: 434.33558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CC(C)N(C1=C(SC(=C1)C2=CC=CC=C2)C(=O)O)C(=O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C21H17Cl2NO3S/c1-12(2)24(20(25)14-8-15(22)10-16(23)9-14)17-11-18(28-19(17)21(26)27)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,26,27)