2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclopropylcarbamoyl)propanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclopropylcarbamoyl)propanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclopropylcarbamoyl)propanamide CAS Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-[(cyclopropylamino)-oxomethyl]propanamide IUPAC Name: 2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(cyclopropylcarbamoyl)propanamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-(cyclopropylcarbamoyl)propionamide Formula: C20H27N5O2S2 MolecularWeight: 433.59068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)SC2=NN=C(N2C3CCCCC3)CC4=CC=CS4

Isomeric SMILES

CC(C(=O)NC(=O)NC1CC1)SC2=NN=C(N2C3CCCCC3)CC4=CC=CS4

InChI

InChI=1S/C20H27N5O2S2/c1-13(18(26)22-19(27)21-14-9-10-14)29-20-24-23-17(12-16-8-5-11-28-16)25(20)15-6-3-2-4-7-15/h5,8,11,13-15H,2-4,6-7,9-10,12H2,1H3,(H2,21,22,26,27)