[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl] 2-[(4-chlorophenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: [2-oxo-2-(2-thienylmethylamino)ethyl] 2-[(4-chlorobenzoyl)amino]-4-methyl-pentanoate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]-4-methylpentanoic acid [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(thiophen-2-ylmethylamino)ethyl] 2-[(4-chlorobenzoyl)amino]-4-methylpentanoate Traditional Name: 2-[(4-chlorobenzoyl)amino]-4-methyl-valeric acid [2-keto-2-(2-thenylamino)ethyl] ester Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)NCC1=CC=CS1)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(C(=O)OCC(=O)NCC1=CC=CS1)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClN2O4S/c1-13(2)10-17(23-19(25)14-5-7-15(21)8-6-14)20(26)27-12-18(24)22-11-16-4-3-9-28-16/h3-9,13,17H,10-12H2,1-2H3,(H,22,24)(H,23,25)