1-[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[7-(5-methyl-2-thienyl)-4,7-dioxo-heptanoyl]piperidine-4-carboxamide CAS Name: 1-[7-(5-methyl-2-thiophenyl)-1,4,7-trioxoheptyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[7-(5-methylthiophen-2-yl)-4,7-dioxoheptanoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[4,7-diketo-7-(5-methyl-2-thienyl)heptanoyl]isonipecotamide Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O4S/c1-18-7-11-23(32-18)22(29)10-8-21(28)9-12-24(30)27-15-13-20(14-16-27)25(31)26-17-19-5-3-2-4-6-19/h2-7,11,20H,8-10,12-17H2,1H3,(H,26,31)