3-(4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzenecarbonitrile

Systemtic Name: 3-(4-ethanoyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzenecarbonitrile Openeye Name: 3-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzonitrile CAS Name: 3-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzonitrile IUPAC Name: 3-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzonitrile Traditional Name: 3-(4-acetyl-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)benzonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)C2=CC=CC(=C2)C#N)(C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N1C(SC(=N1)C2=CC=CC(=C2)C#N)(C)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3OS/c1-13(22)21-18(2,16-9-4-3-5-10-16)23-17(20-21)15-8-6-7-14(11-15)12-19/h3-11H,1-2H3