2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(diethylamino)phenyl]ethanamide

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(diethylamino)phenyl]ethanamide Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(diethylamino)phenyl]acetamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[4-(diethylamino)phenyl]acetamide IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(diethylamino)phenyl]acetamide Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-[4-(diethylamino)phenyl]acetamide Formula: C21H31N5OS MolecularWeight: 401.56874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C21H31N5OS/c1-4-25(5-2)18-13-11-17(12-14-18)22-20(27)15-28-21-24-23-16(3)26(21)19-9-7-6-8-10-19/h11-14,19H,4-10,15H2,1-3H3,(H,22,27)