2-cyano-3-ethylsulfanyl-3-(5-phenyl-1H-pyrrol-2-yl)prop-2-enamide

Systemtic Name: 2-cyano-3-ethylsulfanyl-3-(5-phenyl-1H-pyrrol-2-yl)prop-2-enamide Openeye Name: 2-cyano-3-ethylsulfanyl-3-(5-phenyl-1H-pyrrol-2-yl)prop-2-enamide CAS Name: 2-cyano-3-(ethylthio)-3-(5-phenyl-1H-pyrrol-2-yl)-2-propenamide IUPAC Name: 2-cyano-3-ethylsulfanyl-3-(5-phenyl-1H-pyrrol-2-yl)prop-2-enamide Traditional Name: 2-cyano-3-(ethylthio)-3-(5-phenyl-1H-pyrrol-2-yl)acrylamide Formula: C16H15N3OS MolecularWeight: 297.3748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)C(=O)N)C1=CC=C(N1)C2=CC=CC=C2

Isomeric SMILES

CCSC(=C(C#N)C(=O)N)C1=CC=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C16H15N3OS/c1-2-21-15(12(10-17)16(18)20)14-9-8-13(19-14)11-6-4-3-5-7-11/h3-9,19H,2H2,1H3,(H2,18,20)