3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[5-(2-methylphenyl)carbonyl-1,3-thiazol-2-yl]amino]benzenecarbonitrile Openeye Name: 3-[[5-(2-methylbenzoyl)thiazol-2-yl]amino]benzonitrile CAS Name: 3-[[5-[(2-methylphenyl)-oxomethyl]-2-thiazolyl]amino]benzonitrile IUPAC Name: 3-[[5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino]benzonitrile Traditional Name: 3-[(5-o-toluoylthiazol-2-yl)amino]benzonitrile Formula: C18H13N3OS MolecularWeight: 319.38032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)C2=CN=C(S2)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H13N3OS/c1-12-5-2-3-8-15(12)17(22)16-11-20-18(23-16)21-14-7-4-6-13(9-14)10-19/h2-9,11H,1H3,(H,20,21)