(2R)-N-cycloheptyl-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-propanamide CAS Name: (2R)-N-cycloheptyl-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-cycloheptyl-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-2-[[4-allyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-cycloheptyl-propionamide Formula: C22H30N4O2S MolecularWeight: 414.5642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NN=C(N2CC=C)C3=CC=CC=C3OC

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)SC2=NN=C(N2CC=C)C3=CC=CC=C3OC

InChI

InChI=1S/C22H30N4O2S/c1-4-15-26-20(18-13-9-10-14-19(18)28-3)24-25-22(26)29-16(2)21(27)23-17-11-7-5-6-8-12-17/h4,9-10,13-14,16-17H,1,5-8,11-12,15H2,2-3H3,(H,23,27)/t16-/m1/s1