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

Systemtic Name: 7-chloranyl-2-[[1-(2-thiophen-2-ylethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[1-[2-(2-thienyl)ethyl]tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[[1-(2-thiophen-2-ylethyl)-5-tetrazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[[1-[2-(2-thienyl)ethyl]tetrazol-5-yl]thio]methyl]-1H-quinazolin-4-one Formula: C16H13ClN6OS2 MolecularWeight: 404.89702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCN2C(=NN=N2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1=CSC(=C1)CCN2C(=NN=N2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C16H13ClN6OS2/c17-10-3-4-12-13(8-10)18-14(19-15(12)24)9-26-16-20-21-22-23(16)6-5-11-2-1-7-25-11/h1-4,7-8H,5-6,9H2,(H,18,19,24)