N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-4-(1,2,4-triazol-1-yl)benzamide Formula: C21H14N6O2S MolecularWeight: 414.43986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)NC(=O)C4=CC=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C21H14N6O2S/c28-19(15-6-8-16(9-7-15)26-12-22-11-24-26)25-27-13-23-20-18(21(27)29)17(10-30-20)14-4-2-1-3-5-14/h1-13H,(H,25,28)