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

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(3,4-dimethylphenyl)propan-1-one Openeye Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(3,4-dimethylphenyl)propan-1-one CAS Name: 2-[(1-cyclopentyl-5-tetrazolyl)thio]-1-(3,4-dimethylphenyl)-1-propanone IUPAC Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(3,4-dimethylphenyl)propan-1-one Traditional Name: 2-[(1-cyclopentyltetrazol-5-yl)thio]-1-(3,4-dimethylphenyl)propan-1-one Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NN=NN2C3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NN=NN2C3CCCC3)C

InChI

InChI=1S/C17H22N4OS/c1-11-8-9-14(10-12(11)2)16(22)13(3)23-17-18-19-20-21(17)15-6-4-5-7-15/h8-10,13,15H,4-7H2,1-3H3