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

Systemtic Name: 6-chloranyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[(1-phenyltetrazol-5-yl)thio]methyl]-1H-quinazolin-4-one Formula: C16H11ClN6OS MolecularWeight: 370.81614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClN6OS/c17-10-6-7-13-12(8-10)15(24)19-14(18-13)9-25-16-20-21-22-23(16)11-4-2-1-3-5-11/h1-8H,9H2,(H,18,19,24)