[1-(3-methoxyphenyl)carbonyl-4-[(4-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [1-(3-methoxyphenyl)carbonyl-4-[(4-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [1-(3-methoxybenzoyl)-4-[p-tolylmethyl(2-thienylmethyl)amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [1-[(3-methoxyphenyl)-oxomethyl]-4-[(4-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [1-(3-methoxybenzoyl)-4-[(4-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [1-m-anisoyl-4-[(4-methylbenzyl)-(2-thenyl)amino]pyrrolidin-2-yl]-piperazino-methanone Formula: C30H36N4O3S MolecularWeight: 532.69684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC=CS2)C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCNCC5

InChI

InChI=1S/C30H36N4O3S/c1-22-8-10-23(11-9-22)19-33(21-27-7-4-16-38-27)25-18-28(30(36)32-14-12-31-13-15-32)34(20-25)29(35)24-5-3-6-26(17-24)37-2/h3-11,16-17,25,28,31H,12-15,18-21H2,1-2H3