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

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Openeye Name: 2-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one CAS Name: 2-[[(1-cyclopentyl-5-tetrazolyl)thio]methyl]-8-methyl-1H-quinazolin-4-one IUPAC Name: 2-[(1-cyclopentyltetrazol-5-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[[(1-cyclopentyltetrazol-5-yl)thio]methyl]-8-methyl-1H-quinazolin-4-one Formula: C16H18N6OS MolecularWeight: 342.41872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=NN3C4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NN=NN3C4CCCC4

InChI

InChI=1S/C16H18N6OS/c1-10-5-4-8-12-14(10)17-13(18-15(12)23)9-24-16-19-20-21-22(16)11-6-2-3-7-11/h4-5,8,11H,2-3,6-7,9H2,1H3,(H,17,18,23)