4-[1-cyclohexylcarbonyl-3-(5-methylfuran-2-yl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[1-cyclohexylcarbonyl-3-(5-methylfuran-2-yl)carbonyl-4-(3-methylthiophen-2-yl)-5-piperazin-1-ylcarbonyl-pyrrolidin-2-yl]benzenecarbonitrile Openeye Name: 4-[1-(cyclohexanecarbonyl)-3-(5-methylfuran-2-carbonyl)-4-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile CAS Name: 4-[1-[cyclohexyl(oxo)methyl]-3-[(5-methyl-2-furanyl)-oxomethyl]-4-(3-methyl-2-thiophenyl)-5-[oxo(1-piperazinyl)methyl]-2-pyrrolidinyl]benzonitrile IUPAC Name: 4-[1-(cyclohexanecarbonyl)-3-(5-methylfuran-2-carbonyl)-4-(3-methylthiophen-2-yl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile Traditional Name: 4-[1-(cyclohexanecarbonyl)-3-(5-methyl-2-furoyl)-4-(3-methyl-2-thienyl)-5-(piperazine-1-carbonyl)pyrrolidin-2-yl]benzonitrile Formula: C34H38N4O4S MolecularWeight: 598.75492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4CCCCC4)C5=CC=C(C=C5)C#N)C(=O)C6=CC=C(O6)C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N3CCNCC3)C(=O)C4CCCCC4)C5=CC=C(C=C5)C#N)C(=O)C6=CC=C(O6)C

InChI

InChI=1S/C34H38N4O4S/c1-21-14-19-43-32(21)28-27(31(39)26-13-8-22(2)42-26)29(24-11-9-23(20-35)10-12-24)38(33(40)25-6-4-3-5-7-25)30(28)34(41)37-17-15-36-16-18-37/h8-14,19,25,27-30,36H,3-7,15-18H2,1-2H3