N-(5-oxidanylidene-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-oxidanylidene-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)acetamide CAS Name: N-(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(5-keto-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl)acetamide Formula: C27H24N6O2S MolecularWeight: 496.58346

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)NC2=NC=C3C(=N2)CC(CC3=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)NC2=NC=C3C(=N2)CC(CC3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24N6O2S/c1-2-13-33-25(19-11-7-4-8-12-19)31-32-27(33)36-17-24(35)30-26-28-16-21-22(29-26)14-20(15-23(21)34)18-9-5-3-6-10-18/h2-12,16,20H,1,13-15,17H2,(H,28,29,30,35)