ethyl 3-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]amino]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-(4-benzhydrylpiperazin-1-yl)sulfonylanilino]-3-oxo-propanoate CAS Name: 3-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]anilino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-benzhydrylpiperazin-1-yl)sulfonylanilino]-3-oxopropanoate Traditional Name: 3-[4-(4-benzhydrylpiperazino)sulfonylanilino]-3-keto-propionic acid ethyl ester Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O5S/c1-2-36-27(33)21-26(32)29-24-13-15-25(16-14-24)37(34,35)31-19-17-30(18-20-31)28(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-16,28H,2,17-21H2,1H3,(H,29,32)