methyl 2-methyl-6-[[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]amino]benzoate

Systemtic Name: methyl 2-methyl-6-[[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]amino]benzoate Openeye Name: methyl 2-methyl-6-[[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]amino]benzoate CAS Name: 2-methyl-6-[[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-6-[[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]amino]benzoate Traditional Name: 2-[[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]amino]-6-methyl-benzoic acid methyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)NCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C20H23N3O4S/c1-14-5-3-6-15(18(14)20(26)27-2)21-13-17(24)22-8-10-23(11-9-22)19(25)16-7-4-12-28-16/h3-7,12,21H,8-11,13H2,1-2H3