2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(3-methylphenyl)-6-sulfanylidene-3H-1,3-thiazine-5-carbonitrile

Systemtic Name: 2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(3-methylphenyl)-6-sulfanylidene-3H-1,3-thiazine-5-carbonitrile Openeye Name: 2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(m-tolyl)-6-thioxo-3H-1,3-thiazine-5-carbonitrile CAS Name: 2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(3-methylphenyl)-6-sulfanylidene-3H-1,3-thiazine-5-carbonitrile IUPAC Name: 2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(3-methylphenyl)-6-sulfanylidene-3H-1,3-thiazine-5-carbonitrile Traditional Name: 2-(cyanomethyl)-2-(4-methoxyphenyl)-4-(m-tolyl)-6-thioxo-3H-1,3-thiazine-5-carbonitrile Formula: C21H17N3OS2 MolecularWeight: 391.50918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(C(=S)SC(N2)(CC#N)C3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(C(=S)SC(N2)(CC#N)C3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C21H17N3OS2/c1-14-4-3-5-15(12-14)19-18(13-23)20(26)27-21(24-19,10-11-22)16-6-8-17(25-2)9-7-16/h3-9,12,24H,10H2,1-2H3