8-methyl-2-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 8-methyl-2-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one CAS Name: 8-methyl-2-[[[1-(phenylmethyl)-5-tetrazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1-benzyltetrazol-5-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[[(1-benzyltetrazol-5-yl)thio]methyl]-8-methyl-1H-quinazolin-4-one Formula: C18H16N6OS MolecularWeight: 364.42424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=NN3CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=NN3CC4=CC=CC=C4

InChI

InChI=1S/C18H16N6OS/c1-12-6-5-9-14-16(12)19-15(20-17(14)25)11-26-18-21-22-23-24(18)10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,19,20,25)