3,3-dimethyl-N-[1-(4-methylphenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-(thiophen-2-ylmethyl)butanamide

Systemtic Name: 3,3-dimethyl-N-[1-(4-methylphenyl)carbonyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]-N-(thiophen-2-ylmethyl)butanamide Openeye Name: 3,3-dimethyl-N-[1-(4-methylbenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-(2-thienylmethyl)butanamide CAS Name: 3,3-dimethyl-N-[1-[(4-methylphenyl)-oxomethyl]-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinyl]-N-(thiophen-2-ylmethyl)butanamide IUPAC Name: 3,3-dimethyl-N-[1-(4-methylbenzoyl)-5-(piperazine-1-carbonyl)pyrrolidin-3-yl]-N-(thiophen-2-ylmethyl)butanamide Traditional Name: 3,3-dimethyl-N-[5-(piperazine-1-carbonyl)-1-p-toluoyl-pyrrolidin-3-yl]-N-(2-thenyl)butyramide Formula: C28H38N4O3S MolecularWeight: 510.69132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=CS4)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)N3CCNCC3)N(CC4=CC=CS4)C(=O)CC(C)(C)C

InChI

InChI=1S/C28H38N4O3S/c1-20-7-9-21(10-8-20)26(34)32-18-22(16-24(32)27(35)30-13-11-29-12-14-30)31(19-23-6-5-15-36-23)25(33)17-28(2,3)4/h5-10,15,22,24,29H,11-14,16-19H2,1-4H3