4-(1-cyclopentylcarbonyl-5-phenyl-2-piperazin-1-ylcarbonyl-4-thiophen-2-ylcarbonyl-pyrrolidin-3-yl)benzenecarbonitrile

Systemtic Name: 4-(1-cyclopentylcarbonyl-5-phenyl-2-piperazin-1-ylcarbonyl-4-thiophen-2-ylcarbonyl-pyrrolidin-3-yl)benzenecarbonitrile Openeye Name: 4-[1-(cyclopentanecarbonyl)-5-phenyl-2-(piperazine-1-carbonyl)-4-(thiophene-2-carbonyl)pyrrolidin-3-yl]benzonitrile CAS Name: 4-[1-[cyclopentyl(oxo)methyl]-2-[oxo(1-piperazinyl)methyl]-4-[oxo(thiophen-2-yl)methyl]-5-phenyl-3-pyrrolidinyl]benzonitrile IUPAC Name: 4-[1-(cyclopentanecarbonyl)-5-phenyl-2-(piperazine-1-carbonyl)-4-(thiophene-2-carbonyl)pyrrolidin-3-yl]benzonitrile Traditional Name: 4-[1-(cyclopentanecarbonyl)-5-phenyl-2-(piperazine-1-carbonyl)-4-(2-thenoyl)pyrrolidin-3-yl]benzonitrile Formula: C33H34N4O3S MolecularWeight: 566.71306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=CS5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(C1)C(=O)N2C(C(C(C2C(=O)N3CCNCC3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=CS5)C6=CC=CC=C6

InChI

InChI=1S/C33H34N4O3S/c34-21-22-12-14-23(15-13-22)27-28(31(38)26-11-6-20-41-26)29(24-7-2-1-3-8-24)37(32(39)25-9-4-5-10-25)30(27)33(40)36-18-16-35-17-19-36/h1-3,6-8,11-15,20,25,27-30,35H,4-5,9-10,16-19H2