3-[(2,4-dichlorophenyl)carbonyl-propan-2-yl-amino]-5-(1-phenylmethoxycarbonyl-3,6-dihydro-2H-pyridin-4-yl)thiophene-2-carboxylic acid

Systemtic Name: 3-[(2,4-dichlorophenyl)carbonyl-propan-2-yl-amino]-5-(1-phenylmethoxycarbonyl-3,6-dihydro-2H-pyridin-4-yl)thiophene-2-carboxylic acid Openeye Name: 5-(1-benzyloxycarbonyl-3,6-dihydro-2H-pyridin-4-yl)-3-[(2,4-dichlorobenzoyl)-isopropyl-amino]thiophene-2-carboxylic acid CAS Name: 3-[[(2,4-dichlorophenyl)-oxomethyl]-propan-2-ylamino]-5-(1-phenylmethoxycarbonyl-3,6-dihydro-2H-pyridin-4-yl)-2-thiophenecarboxylic acid IUPAC Name: 3-[(2,4-dichlorobenzoyl)-propan-2-ylamino]-5-(1-phenylmethoxycarbonyl-3,6-dihydro-2H-pyridin-4-yl)thiophene-2-carboxylic acid Traditional Name: 5-(1-carbobenzoxy-3,6-dihydro-2H-pyridin-4-yl)-3-[(2,4-dichlorobenzoyl)-isopropyl-amino]-2-thenoic acid Formula: C28H26Cl2N2O5S MolecularWeight: 573.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=C(SC(=C1)C2=CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC(C)N(C1=C(SC(=C1)C2=CCN(CC2)C(=O)OCC3=CC=CC=C3)C(=O)O)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C28H26Cl2N2O5S/c1-17(2)32(26(33)21-9-8-20(29)14-22(21)30)23-15-24(38-25(23)27(34)35)19-10-12-31(13-11-19)28(36)37-16-18-6-4-3-5-7-18/h3-10,14-15,17H,11-13,16H2,1-2H3,(H,34,35)