5-[(2-methoxy-4-phenyl-phenyl)amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-[(2-methoxy-4-phenyl-phenyl)amino]-3-oxidanylidene-1,2-thiazole-4-carbonitrile Openeye Name: 5-(2-methoxy-4-phenyl-anilino)-3-oxo-isothiazole-4-carbonitrile CAS Name: 5-(2-methoxy-4-phenylanilino)-3-oxo-4-isothiazolecarbonitrile IUPAC Name: 5-(2-methoxy-4-phenylanilino)-3-oxo-1,2-thiazole-4-carbonitrile Traditional Name: 3-keto-5-(2-methoxy-4-phenyl-anilino)-4-isothiazoline-4-carbonitrile Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC=CC=C2)NC3=C(C(=O)NS3)C#N

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC=CC=C2)NC3=C(C(=O)NS3)C#N

InChI

InChI=1S/C17H13N3O2S/c1-22-15-9-12(11-5-3-2-4-6-11)7-8-14(15)19-17-13(10-18)16(21)20-23-17/h2-9,19H,1H3,(H,20,21)