3H-1,3-benzothiazol-2-ylidene-[(4R)-8-methyl-4-(4-methylphenyl)-5-oxidanylidene-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]azanium

Systemtic Name: 3H-1,3-benzothiazol-2-ylidene-[(4R)-8-methyl-4-(4-methylphenyl)-5-oxidanylidene-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]azanium Openeye Name: 3H-1,3-benzothiazol-2-ylidene-[(4R)-8-methyl-5-oxo-4-(p-tolyl)-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]ammonium CAS Name: 3H-1,3-benzothiazol-2-ylidene-[(4R)-8-methyl-4-(4-methylphenyl)-5-oxo-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]ammonium IUPAC Name: 3H-1,3-benzothiazol-2-ylidene-[(4R)-8-methyl-4-(4-methylphenyl)-5-oxo-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]azanium Traditional Name: 3H-1,3-benzothiazol-2-ylidene-[(4R)-5-keto-8-methyl-4-(p-tolyl)-1,4-dihydropyrano[4,3-d]pyrimidin-2-yl]ammonium Formula: C22H19N4O2S+ MolecularWeight: 403.47686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(C(=COC3=O)C)NC(=N2)[NH+]=C4NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C3=C(C(=COC3=O)C)NC(=N2)[NH+]=C4NC5=CC=CC=C5S4

InChI

InChI=1S/C22H18N4O2S/c1-12-7-9-14(10-8-12)19-17-18(13(2)11-28-20(17)27)24-21(25-19)26-22-23-15-5-3-4-6-16(15)29-22/h3-11,19H,1-2H3,(H2,23,24,25,26)/p+1/t19-/m1/s1