N-[3-[3-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-[(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-[(8-methyl-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-[(4-keto-8-methyl-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=CN3C4=CC(=CC=C4)NC(=O)C

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=CN3C4=CC(=CC=C4)NC(=O)C

InChI

InChI=1S/C20H18N6O2S/c1-12-5-3-8-16-18(12)23-17(24-19(16)28)10-29-20-25-21-11-26(20)15-7-4-6-14(9-15)22-13(2)27/h3-9,11H,10H2,1-2H3,(H,22,27)(H,23,24,28)