1-[3-(4-methoxyphenyl)-4-(4-methoxyphenyl)carbonyl-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3-(4-methoxyphenyl)-4-(4-methoxyphenyl)carbonyl-2-piperazin-1-ylcarbonyl-5-thiophen-2-yl-pyrrolidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-(4-methoxybenzoyl)-3-(4-methoxyphenyl)-2-(piperazine-1-carbonyl)-5-(2-thienyl)pyrrolidin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-(4-methoxyphenyl)-4-[(4-methoxyphenyl)-oxomethyl]-2-[oxo(1-piperazinyl)methyl]-5-thiophen-2-yl-1-pyrrolidinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-(4-methoxybenzoyl)-3-(4-methoxyphenyl)-2-(piperazine-1-carbonyl)-5-thiophen-2-ylpyrrolidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[3-(4-methoxyphenyl)-4-p-anisoyl-2-(piperazine-1-carbonyl)-5-(2-thienyl)pyrrolidino]-3-methyl-butan-1-one Formula: C33H39N3O5S MolecularWeight: 589.74486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)OC)C5=CC=CS5

Isomeric SMILES

CC(C)CC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC=C(C=C3)OC)C(=O)C4=CC=C(C=C4)OC)C5=CC=CS5

InChI

InChI=1S/C33H39N3O5S/c1-21(2)20-27(37)36-30(26-6-5-19-42-26)29(32(38)23-9-13-25(41-4)14-10-23)28(22-7-11-24(40-3)12-8-22)31(36)33(39)35-17-15-34-16-18-35/h5-14,19,21,28-31,34H,15-18,20H2,1-4H3