2-azanyl-4-(3,4-dimethoxyphenyl)-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,4-dimethoxyphenyl)-5-oxidanylidene-4H-thiochromeno[4,3-b]pyran-3-carbonitrile Openeye Name: 2-amino-4-(3,4-dimethoxyphenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carbonitrile CAS Name: 2-amino-4-(3,4-dimethoxyphenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(3,4-dimethoxyphenyl)-5-oxo-4H-thiochromeno[4,3-b]pyran-3-carbonitrile Traditional Name: 2-amino-4-(3,4-dimethoxyphenyl)-5-keto-4H-thiochromeno[4,3-b]pyran-3-carbonitrile Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)SC4=CC=CC=C43)N)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC3=C2C(=O)SC4=CC=CC=C43)N)C#N)OC

InChI

InChI=1S/C21H16N2O4S/c1-25-14-8-7-11(9-15(14)26-2)17-13(10-22)20(23)27-19-12-5-3-4-6-16(12)28-21(24)18(17)19/h3-9,17H,23H2,1-2H3