(2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanamide Openeye Name: (2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[1-(o-tolyl)tetrazol-5-yl]sulfanyl-propanamide CAS Name: (2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[[1-(2-methylphenyl)-5-tetrazolyl]thio]propanamide IUPAC Name: (2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[1-(2-methylphenyl)tetrazol-5-yl]sulfanylpropanamide Traditional Name: (2R)-N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-[[1-(o-tolyl)tetrazol-5-yl]thio]propionamide Formula: C19H27N5OS MolecularWeight: 373.51558

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C(C)SC2=NN=NN2C3=CC=CC=C3C

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@H]1C)NC(=O)[C@@H](C)SC2=NN=NN2C3=CC=CC=C3C

InChI

InChI=1S/C19H27N5OS/c1-12-9-7-10-16(14(12)3)20-18(25)15(4)26-19-21-22-23-24(19)17-11-6-5-8-13(17)2/h5-6,8,11-12,14-16H,7,9-10H2,1-4H3,(H,20,25)/t12-,14-,15+,16-/m0/s1