2-[(E)-cyano-(5-methyl-3-phenethyl-1,3-thiazol-2-ylidene)methyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-cyano-(5-methyl-3-phenethyl-1,3-thiazol-2-ylidene)methyl]benzenecarbonitrile Openeye Name: 2-[(E)-cyano-(5-methyl-3-phenethyl-thiazol-2-ylidene)methyl]benzonitrile CAS Name: 2-[(E)-cyano-(5-methyl-3-phenethyl-2-thiazolylidene)methyl]benzonitrile IUPAC Name: 2-[(E)-cyano-(5-methyl-3-phenethyl-1,3-thiazol-2-ylidene)methyl]benzonitrile Traditional Name: 2-[(E)-cyano-(5-methyl-3-phenethyl-4-thiazolin-2-ylidene)methyl]benzonitrile Formula: C21H17N3S MolecularWeight: 343.44478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C(C#N)C2=CC=CC=C2C#N)S1)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CN(/C(=C(\C#N)/C2=CC=CC=C2C#N)/S1)CCC3=CC=CC=C3

InChI

InChI=1S/C21H17N3S/c1-16-15-24(12-11-17-7-3-2-4-8-17)21(25-16)20(14-23)19-10-6-5-9-18(19)13-22/h2-10,15H,11-12H2,1H3/b21-20-