6,7-dimethoxy-2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]quinoline-3-carbonitrile

Systemtic Name: 6,7-dimethoxy-2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]quinoline-3-carbonitrile Openeye Name: 6,7-dimethoxy-2-[(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]quinoline-3-carbonitrile CAS Name: 6,7-dimethoxy-2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]-3-quinolinecarbonitrile IUPAC Name: 6,7-dimethoxy-2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]quinoline-3-carbonitrile Traditional Name: 6,7-dimethoxy-2-[(2-thioxo-3H-1,3-benzothiazol-6-yl)amino]quinoline-3-carbonitrile Formula: C19H14N4O2S2 MolecularWeight: 394.47006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=N2)NC3=CC4=C(C=C3)NC(=S)S4)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=N2)NC3=CC4=C(C=C3)NC(=S)S4)C#N)OC

InChI

InChI=1S/C19H14N4O2S2/c1-24-15-6-10-5-11(9-20)18(22-14(10)8-16(15)25-2)21-12-3-4-13-17(7-12)27-19(26)23-13/h3-8H,1-2H3,(H,21,22)(H,23,26)