7-chloranyl-2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[(1-isopropyltetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(1-propan-2-yl-5-tetrazolyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(1-propan-2-yltetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(1-isopropyltetrazol-5-yl)thio]methyl]-1H-quinazolin-4-one Formula: C13H13ClN6OS MolecularWeight: 336.79992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C)N1C(=NN=N1)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C13H13ClN6OS/c1-7(2)20-13(17-18-19-20)22-6-11-15-10-5-8(14)3-4-9(10)12(21)16-11/h3-5,7H,6H2,1-2H3,(H,15,16,21)