4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxy-quinoline-3-carbonitrile Openeye Name: 4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxy-quinoline-3-carbonitrile CAS Name: 4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxy-3-quinolinecarbonitrile IUPAC Name: 4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxyquinoline-3-carbonitrile Traditional Name: 4-(1,3-benzothiazol-6-ylamino)-6,7-diethoxy-quinoline-3-carbonitrile Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N=CS4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)N=CS4)OCC

InChI

InChI=1S/C21H18N4O2S/c1-3-26-18-8-15-17(9-19(18)27-4-2)23-11-13(10-22)21(15)25-14-5-6-16-20(7-14)28-12-24-16/h5-9,11-12H,3-4H2,1-2H3,(H,23,25)