1-[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[4-(5-chloro-2-thienyl)-4-oxo-butanoyl]piperidine-4-carboxamide CAS Name: 1-[4-(5-chloro-2-thiophenyl)-1,4-dioxobutyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[4-(5-chlorothiophen-2-yl)-4-oxobutanoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[4-(5-chloro-2-thienyl)-4-keto-butanoyl]isonipecotamide Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2)C(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C21H23ClN2O3S/c22-19-8-7-18(28-19)17(25)6-9-20(26)24-12-10-16(11-13-24)21(27)23-14-15-4-2-1-3-5-15/h1-5,7-8,16H,6,9-14H2,(H,23,27)