ethyl 4-[(4-oxidanylidene-6-phenyl-thieno[2,3-d][1,2,3]triazin-3-yl)methyl]benzoate

Systemtic Name: ethyl 4-[(4-oxidanylidene-6-phenyl-thieno[2,3-d][1,2,3]triazin-3-yl)methyl]benzoate Openeye Name: ethyl 4-[(4-oxo-6-phenyl-thieno[2,3-d]triazin-3-yl)methyl]benzoate CAS Name: 4-[(4-oxo-6-phenyl-3-thieno[2,3-d]triazinyl)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-oxo-6-phenylthieno[2,3-d]triazin-3-yl)methyl]benzoate Traditional Name: 4-[(4-keto-6-phenyl-thieno[2,3-d]triazin-3-yl)methyl]benzoic acid ethyl ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN2C(=O)C3=C(N=N2)SC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN2C(=O)C3=C(N=N2)SC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O3S/c1-2-27-21(26)16-10-8-14(9-11-16)13-24-20(25)17-12-18(28-19(17)22-23-24)15-6-4-3-5-7-15/h3-12H,2,13H2,1H3