N-[4-[(E)-C-methyl-N-(octanoylamino)carbonimidoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(E)-C-methyl-N-(octanoylamino)carbonimidoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[(E)-C-methyl-N-(octanoylamino)carbonimidoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[(1E)-1-(1-oxooctylhydrazinylidene)ethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(E)-C-methyl-N-(octanoylamino)carbonimidoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[(E)-N-(caprylylamino)-C-methyl-carbonimidoyl]phenyl]thiophene-2-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2S/c1-3-4-5-6-7-10-20(25)24-23-16(2)17-11-13-18(14-12-17)22-21(26)19-9-8-15-27-19/h8-9,11-15H,3-7,10H2,1-2H3,(H,22,26)(H,24,25)/b23-16+