1-[3-(3-chlorophenyl)carbonyl-2-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]-2-methoxy-ethanone

Systemtic Name: 1-[3-(3-chlorophenyl)carbonyl-2-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-4-thiophen-2-yl-pyrrolidin-1-yl]-2-methoxy-ethanone Openeye Name: 1-[3-(3-chlorobenzoyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-4-(2-thienyl)pyrrolidin-1-yl]-2-methoxy-ethanone CAS Name: 1-[3-[(3-chlorophenyl)-oxomethyl]-2-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-4-thiophen-2-yl-1-pyrrolidinyl]-2-methoxyethanone IUPAC Name: 1-[3-(3-chlorobenzoyl)-2-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)-4-thiophen-2-ylpyrrolidin-1-yl]-2-methoxyethanone Traditional Name: 1-[3-(3-chlorobenzoyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-4-(2-thienyl)pyrrolidino]-2-methoxy-ethanone Formula: C28H30ClN3O4S2 MolecularWeight: 572.1385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)COC)C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)COC)C(=O)N3CCNCC3)C4=CC=CS4)C(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H30ClN3O4S2/c1-17-8-14-38-27(17)24-23(26(34)18-5-3-6-19(29)15-18)22(20-7-4-13-37-20)25(32(24)21(33)16-36-2)28(35)31-11-9-30-10-12-31/h3-8,13-15,22-25,30H,9-12,16H2,1-2H3