N-[(2S)-1-(cyanomethylamino)-1-oxidanylidene-3-prop-2-enylsulfanyl-propan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-1-oxidanylidene-3-prop-2-enylsulfanyl-propan-2-yl]benzamide Openeye Name: N-[(1S)-1-(allylsulfanylmethyl)-2-(cyanomethylamino)-2-oxo-ethyl]benzamide CAS Name: N-[(2S)-1-(cyanomethylamino)-1-oxo-3-(prop-2-enylthio)propan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-1-oxo-3-prop-2-enylsulfanylpropan-2-yl]benzamide Traditional Name: N-[(1S)-1-[(allylthio)methyl]-2-(cyanomethylamino)-2-keto-ethyl]benzamide Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSCC(C(=O)NCC#N)NC(=O)C1=CC=CC=C1

Isomeric SMILES

C=CCSC[C@H](C(=O)NCC#N)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C15H17N3O2S/c1-2-10-21-11-13(15(20)17-9-8-16)18-14(19)12-6-4-3-5-7-12/h2-7,13H,1,9-11H2,(H,17,20)(H,18,19)/t13-/m1/s1