1-[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: 1-[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: 1-[7-(5-methyl-2-thienyl)-4,7-dioxo-heptanoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: 1-[7-(5-methyl-2-thiophenyl)-1,4,7-trioxoheptyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: 1-[7-(5-methylthiophen-2-yl)-4,7-dioxoheptanoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: 1-[4,7-diketo-7-(5-methyl-2-thienyl)heptanoyl]-N-phenyl-nipecotamide Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4S/c1-17-9-13-22(31-17)21(28)12-10-20(27)11-14-23(29)26-15-5-6-18(16-26)24(30)25-19-7-3-2-4-8-19/h2-4,7-9,13,18H,5-6,10-12,14-16H2,1H3,(H,25,30)