N-[3-[(E)-N-(decanoylamino)-C-methyl-carbonimidoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(E)-N-(decanoylamino)-C-methyl-carbonimidoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[(E)-N-(decanoylamino)-C-methyl-carbonimidoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[(1E)-1-(1-oxodecylhydrazinylidene)ethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(E)-N-(decanoylamino)-C-methylcarbonimidoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[(E)-N-(caprylamino)-C-methyl-carbonimidoyl]phenyl]thiophene-2-carboxamide Formula: C23H31N3O2S MolecularWeight: 413.57614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NN=C(C)C1=CC(=CC=C1)NC(=O)C2=CC=CS2

Isomeric SMILES

CCCCCCCCCC(=O)N/N=C(\C)/C1=CC(=CC=C1)NC(=O)C2=CC=CS2

InChI

InChI=1S/C23H31N3O2S/c1-3-4-5-6-7-8-9-15-22(27)26-25-18(2)19-12-10-13-20(17-19)24-23(28)21-14-11-16-29-21/h10-14,16-17H,3-9,15H2,1-2H3,(H,24,28)(H,26,27)/b25-18+