2-methoxy-1-[2-(4-methoxyphenyl)-3-(4-methylsulfanylphenyl)carbonyl-4-phenyl-5-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[2-(4-methoxyphenyl)-3-(4-methylsulfanylphenyl)carbonyl-4-phenyl-5-piperazin-1-ylcarbonyl-pyrrolidin-1-yl]ethanone Openeye Name: 2-methoxy-1-[2-(4-methoxyphenyl)-3-(4-methylsulfanylbenzoyl)-4-phenyl-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone CAS Name: 2-methoxy-1-[2-(4-methoxyphenyl)-3-[[4-(methylthio)phenyl]-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-4-phenyl-1-pyrrolidinyl]ethanone IUPAC Name: 2-methoxy-1-[2-(4-methoxyphenyl)-3-(4-methylsulfanylbenzoyl)-4-phenyl-5-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-methoxy-1-[2-(4-methoxyphenyl)-3-[4-(methylthio)benzoyl]-4-phenyl-5-(piperazine-1-carbonyl)pyrrolidino]ethanone Formula: C33H37N3O5S MolecularWeight: 587.72898

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)SC)C5=CC=C(C=C5)OC

Isomeric SMILES

COCC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)SC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H37N3O5S/c1-40-21-27(37)36-30(23-9-13-25(41-2)14-10-23)29(32(38)24-11-15-26(42-3)16-12-24)28(22-7-5-4-6-8-22)31(36)33(39)35-19-17-34-18-20-35/h4-16,28-31,34H,17-21H2,1-3H3