[4-(4-tert-butylphenyl)-2-(2-phenylethenyl)-5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-(4-tert-butylphenyl)-2-(2-phenylethenyl)-5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl]-thiophen-2-yl-methanone Openeye Name: [4-(4-tert-butylphenyl)-5-(piperazine-1-carbonyl)-2-styryl-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]-(2-thienyl)methanone CAS Name: [4-(4-tert-butylphenyl)-5-[oxo(1-piperazinyl)methyl]-1-[oxo(thiophen-2-yl)methyl]-2-(2-phenylethenyl)-3-pyrrolidinyl]-thiophen-2-ylmethanone IUPAC Name: [4-(4-tert-butylphenyl)-2-(2-phenylethenyl)-5-(piperazine-1-carbonyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]-thiophen-2-ylmethanone Traditional Name: [4-(4-tert-butylphenyl)-5-(piperazine-1-carbonyl)-2-styryl-1-(2-thenoyl)pyrrolidin-3-yl]-(2-thienyl)methanone Formula: C37H39N3O3S2 MolecularWeight: 637.85386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4=CC=CS4)C=CC5=CC=CC=C5)C(=O)C6=CC=CS6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4=CC=CS4)C=CC5=CC=CC=C5)C(=O)C6=CC=CS6

InChI

InChI=1S/C37H39N3O3S2/c1-37(2,3)27-16-14-26(15-17-27)31-32(34(41)29-11-7-23-44-29)28(18-13-25-9-5-4-6-10-25)40(35(42)30-12-8-24-45-30)33(31)36(43)39-21-19-38-20-22-39/h4-18,23-24,28,31-33,38H,19-22H2,1-3H3