1-(4-chlorophenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-chlorophenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(4-chlorophenyl)-2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(4-chlorophenyl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(4-chlorophenyl)-2-[(1-cyclopropyltetrazol-5-yl)thio]propan-1-one Formula: C13H13ClN4OS MolecularWeight: 308.78652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)SC2=NN=NN2C3CC3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)SC2=NN=NN2C3CC3

InChI

InChI=1S/C13H13ClN4OS/c1-8(12(19)9-2-4-10(14)5-3-9)20-13-15-16-17-18(13)11-6-7-11/h2-5,8,11H,6-7H2,1H3