(2R)-2-(aminocarbonylamino)-N-[4-(cyanomethyl)phenyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2R)-2-(aminocarbonylamino)-N-[4-(cyanomethyl)phenyl]-4-methylsulfanyl-butanamide Openeye Name: (2R)-N-[4-(cyanomethyl)phenyl]-4-methylsulfanyl-2-ureido-butanamide CAS Name: (2R)-2-(carbamoylamino)-N-[4-(cyanomethyl)phenyl]-4-(methylthio)butanamide IUPAC Name: (2R)-2-(carbamoylamino)-N-[4-(cyanomethyl)phenyl]-4-methylsulfanylbutanamide Traditional Name: (2R)-N-[4-(cyanomethyl)phenyl]-4-(methylthio)-2-ureido-butyramide Formula: C14H18N4O2S MolecularWeight: 306.38332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)N

Isomeric SMILES

CSCC[C@H](C(=O)NC1=CC=C(C=C1)CC#N)NC(=O)N

InChI

InChI=1S/C14H18N4O2S/c1-21-9-7-12(18-14(16)20)13(19)17-11-4-2-10(3-5-11)6-8-15/h2-5,12H,6-7,9H2,1H3,(H,17,19)(H3,16,18,20)/t12-/m1/s1