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

Systemtic Name: 1-[4-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-3-thiophen-2-ylcarbonyl-pyrrolidin-1-yl]-2-methoxy-ethanone Openeye Name: 1-[4-(4-chlorophenyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidin-1-yl]-2-methoxy-ethanone CAS Name: 1-[4-(4-chlorophenyl)-2-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-3-[oxo(thiophen-2-yl)methyl]-1-pyrrolidinyl]-2-methoxyethanone IUPAC Name: 1-[4-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidin-1-yl]-2-methoxyethanone Traditional Name: 1-[4-(4-chlorophenyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-3-(2-thenoyl)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=C(C=C4)Cl)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)COC)C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CS5

InChI

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