2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-6-chloranyl-1H-quinazolin-4-one

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-6-chloranyl-1H-quinazolin-4-one Openeye Name: 2-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-6-chloro-1H-quinazolin-4-one CAS Name: 2-[[(1-tert-butyl-5-tetrazolyl)thio]methyl]-6-chloro-1H-quinazolin-4-one IUPAC Name: 2-[(1-tert-butyltetrazol-5-yl)sulfanylmethyl]-6-chloro-1H-quinazolin-4-one Traditional Name: 2-[[(1-tert-butyltetrazol-5-yl)thio]methyl]-6-chloro-1H-quinazolin-4-one Formula: C14H15ClN6OS MolecularWeight: 350.8265

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN6OS/c1-14(2,3)21-13(18-19-20-21)23-7-11-16-10-5-4-8(15)6-9(10)12(22)17-11/h4-6H,7H2,1-3H3,(H,16,17,22)