N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C18H21N5OS/c1-12(2)17-21-22-18(23(17)15-7-8-15)25-11-16(24)20-14-5-3-13(4-6-14)9-10-19/h3-6,12,15H,7-9,11H2,1-2H3,(H,20,24)