N-[1-(cyanomethylamino)-3-[(2-methylphenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[1-(cyanomethylamino)-3-[(2-methylphenyl)methylsulfanyl]-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[2-(cyanomethylamino)-1-(o-tolylmethylsulfanylmethyl)-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[1-(cyanomethylamino)-3-[(2-methylphenyl)methylthio]-1-oxopropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-(cyanomethylamino)-3-[(2-methylphenyl)methylsulfanyl]-1-oxopropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[2-(cyanomethylamino)-2-keto-1-[[(2-methylbenzyl)thio]methyl]ethyl]morpholine-4-carboxamide Formula: C18H24N4O3S MolecularWeight: 376.47316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(C(=O)NCC#N)NC(=O)N2CCOCC2

Isomeric SMILES

CC1=CC=CC=C1CSCC(C(=O)NCC#N)NC(=O)N2CCOCC2

InChI

InChI=1S/C18H24N4O3S/c1-14-4-2-3-5-15(14)12-26-13-16(17(23)20-7-6-19)21-18(24)22-8-10-25-11-9-22/h2-5,16H,7-13H2,1H3,(H,20,23)(H,21,24)