3,3-dimethyl-N-phenethyl-N-(5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl)butanamide

Systemtic Name: 3,3-dimethyl-N-phenethyl-N-(5-piperazin-1-ylcarbonyl-1-thiophen-2-ylcarbonyl-pyrrolidin-3-yl)butanamide Openeye Name: 3,3-dimethyl-N-phenethyl-N-[5-(piperazine-1-carbonyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]butanamide CAS Name: 3,3-dimethyl-N-[5-[oxo(1-piperazinyl)methyl]-1-[oxo(thiophen-2-yl)methyl]-3-pyrrolidinyl]-N-phenethylbutanamide IUPAC Name: 3,3-dimethyl-N-phenethyl-N-[5-(piperazine-1-carbonyl)-1-(thiophene-2-carbonyl)pyrrolidin-3-yl]butanamide Traditional Name: 3,3-dimethyl-N-phenethyl-N-[5-(piperazine-1-carbonyl)-1-(2-thenoyl)pyrrolidin-3-yl]butyramide Formula: C28H38N4O3S MolecularWeight: 510.69132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC=CS3)C(=O)N4CCNCC4

Isomeric SMILES

CC(C)(C)CC(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC=CS3)C(=O)N4CCNCC4

InChI

InChI=1S/C28H38N4O3S/c1-28(2,3)19-25(33)31(14-11-21-8-5-4-6-9-21)22-18-23(26(34)30-15-12-29-13-16-30)32(20-22)27(35)24-10-7-17-36-24/h4-10,17,22-23,29H,11-16,18-20H2,1-3H3