N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide CAS Name: N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxyphenyl)acetamide Formula: C18H21N5O2S MolecularWeight: 371.45664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC(=O)N(CCC#N)C3=CC=CC=C3OC

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC(=O)N(CCC#N)C3=CC=CC=C3OC

InChI

InChI=1S/C18H21N5O2S/c1-13-20-21-18(23(13)14-8-9-14)26-12-17(24)22(11-5-10-19)15-6-3-4-7-16(15)25-2/h3-4,6-7,14H,5,8-9,11-12H2,1-2H3