N-[(2S)-1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-5-methylsulfanyl-thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-(cyanomethylamino)-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-5-methylsulfanyl-thiophene-2-carboxamide Openeye Name: N-[(1S)-2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-oxo-ethyl]-5-methylsulfanyl-thiophene-2-carboxamide CAS Name: N-[(2S)-1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-5-(methylthio)-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-(cyanomethylamino)-3-cyclohexyl-1-oxopropan-2-yl]-5-methylsulfanylthiophene-2-carboxamide Traditional Name: N-[(1S)-2-(cyanomethylamino)-1-(cyclohexylmethyl)-2-keto-ethyl]-5-(methylthio)thiophene-2-carboxamide Formula: C17H23N3O2S2 MolecularWeight: 365.51342

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(S1)C(=O)NC(CC2CCCCC2)C(=O)NCC#N

Isomeric SMILES

CSC1=CC=C(S1)C(=O)N[C@@H](CC2CCCCC2)C(=O)NCC#N

InChI

InChI=1S/C17H23N3O2S2/c1-23-15-8-7-14(24-15)17(22)20-13(16(21)19-10-9-18)11-12-5-3-2-4-6-12/h7-8,12-13H,2-6,10-11H2,1H3,(H,19,21)(H,20,22)/t13-/m0/s1