2-[2,2-dicyano-1-[(phenylmethyl)amino]ethenyl]sulfanyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2,2-dicyano-1-[(phenylmethyl)amino]ethenyl]sulfanyl-N-propan-2-yl-ethanamide Openeye Name: 2-[1-(benzylamino)-2,2-dicyano-vinyl]sulfanyl-N-isopropyl-acetamide CAS Name: 2-[[2,2-dicyano-1-[(phenylmethyl)amino]ethenyl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[1-(benzylamino)-2,2-dicyanoethenyl]sulfanyl-N-propan-2-ylacetamide Traditional Name: 2-[[1-(benzylamino)-2,2-dicyano-vinyl]thio]-N-isopropyl-acetamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC(=C(C#N)C#N)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)NC(=O)CSC(=C(C#N)C#N)NCC1=CC=CC=C1

InChI

InChI=1S/C16H18N4OS/c1-12(2)20-15(21)11-22-16(14(8-17)9-18)19-10-13-6-4-3-5-7-13/h3-7,12,19H,10-11H2,1-2H3,(H,20,21)