4-methoxy-N-[[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-methoxy-N-[[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-methoxy-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-methoxy-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-methoxy-N-[[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[5-[(4-keto-1H-quinazolin-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C26H22N6O3S MolecularWeight: 498.55628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C26H22N6O3S/c1-35-19-13-11-17(12-14-19)24(33)27-15-23-30-31-26(32(23)18-7-3-2-4-8-18)36-16-22-28-21-10-6-5-9-20(21)25(34)29-22/h2-14H,15-16H2,1H3,(H,27,33)(H,28,29,34)