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

Systemtic Name: 1-[4-(4-tert-butylphenyl)-2-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-3-thiophen-2-ylcarbonyl-pyrrolidin-1-yl]-2-methoxy-ethanone Openeye Name: 1-[4-(4-tert-butylphenyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidin-1-yl]-2-methoxy-ethanone CAS Name: 1-[4-(4-tert-butylphenyl)-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-tert-butylphenyl)-2-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)-3-(thiophene-2-carbonyl)pyrrolidin-1-yl]-2-methoxyethanone Traditional Name: 1-[4-(4-tert-butylphenyl)-2-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)-3-(2-thenoyl)pyrrolidino]-2-methoxy-ethanone Formula: C32H39N3O4S2 MolecularWeight: 593.79976

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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)C(C)(C)C)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)C(C)(C)C)C(=O)C5=CC=CS5

InChI

InChI=1S/C32H39N3O4S2/c1-20-12-18-41-30(20)27-26(29(37)23-7-6-17-40-23)25(21-8-10-22(11-9-21)32(2,3)4)28(35(27)24(36)19-39-5)31(38)34-15-13-33-14-16-34/h6-12,17-18,25-28,33H,13-16,19H2,1-5H3