5-(1-benzothiophen-2-yl)-1-butyl-2-oxidanylidene-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: 5-(1-benzothiophen-2-yl)-1-butyl-2-oxidanylidene-N-phenethyl-pyridine-3-carboxamide Openeye Name: 5-(benzothiophen-2-yl)-1-butyl-2-oxo-N-phenethyl-pyridine-3-carboxamide CAS Name: 5-(1-benzothiophen-2-yl)-1-butyl-2-oxo-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 5-(1-benzothiophen-2-yl)-1-butyl-2-oxo-N-phenethylpyridine-3-carboxamide Traditional Name: 5-(benzothiophen-2-yl)-1-butyl-2-keto-N-phenethyl-nicotinamide Formula: C26H26N2O2S MolecularWeight: 430.56184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=C(C1=O)C(=O)NCCC2=CC=CC=C2)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CCCCN1C=C(C=C(C1=O)C(=O)NCCC2=CC=CC=C2)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C26H26N2O2S/c1-2-3-15-28-18-21(24-17-20-11-7-8-12-23(20)31-24)16-22(26(28)30)25(29)27-14-13-19-9-5-4-6-10-19/h4-12,16-18H,2-3,13-15H2,1H3,(H,27,29)