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

Systemtic Name: 7-chloranyl-2-[[1-(4-propan-2-ylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[1-(4-isopropylphenyl)tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[1-(4-propan-2-ylphenyl)-5-tetrazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[1-(4-propan-2-ylphenyl)tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(1-p-cumenyltetrazol-5-yl)thio]methyl]-1H-quinazolin-4-one Formula: C19H17ClN6OS MolecularWeight: 412.89588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C19H17ClN6OS/c1-11(2)12-3-6-14(7-4-12)26-19(23-24-25-26)28-10-17-21-16-9-13(20)5-8-15(16)18(27)22-17/h3-9,11H,10H2,1-2H3,(H,21,22,27)