2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(3,4-dimethylphenyl)ethanone Openeye Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(3,4-dimethylphenyl)ethanone CAS Name: 2-[(1-cyclopentyl-5-tetrazolyl)thio]-1-(3,4-dimethylphenyl)ethanone IUPAC Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(3,4-dimethylphenyl)ethanone Traditional Name: 2-[(1-cyclopentyltetrazol-5-yl)thio]-1-(3,4-dimethylphenyl)ethanone Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NN=NN2C3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NN=NN2C3CCCC3)C

InChI

InChI=1S/C16H20N4OS/c1-11-7-8-13(9-12(11)2)15(21)10-22-16-17-18-19-20(16)14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3