N-(cyclohexylcarbamoyl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(cyclohexylcarbamoyl)-2-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C22H31N5O3S MolecularWeight: 445.57824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC(C)C(=O)NC(=O)NC2CCCCC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SC(C)C(=O)NC(=O)NC2CCCCC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H31N5O3S/c1-14(2)27-19(16-10-12-18(30-4)13-11-16)25-26-22(27)31-15(3)20(28)24-21(29)23-17-8-6-5-7-9-17/h10-15,17H,5-9H2,1-4H3,(H2,23,24,28,29)