(2R)-N-cycloheptyl-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-cycloheptyl-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-cycloheptyl-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-cycloheptyl-2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-cycloheptyl-2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C)C(=O)NC2CCCCCC2)C3=CC(=CC=C3)C

Isomeric SMILES

CCCN1C(=NN=C1S[C@H](C)C(=O)NC2CCCCCC2)C3=CC(=CC=C3)C

InChI

InChI=1S/C22H32N4OS/c1-4-14-26-20(18-11-9-10-16(2)15-18)24-25-22(26)28-17(3)21(27)23-19-12-7-5-6-8-13-19/h9-11,15,17,19H,4-8,12-14H2,1-3H3,(H,23,27)/t17-/m1/s1