N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1S)-3-methylsulfanyl-1-(thiazol-4-ylmethylcarbamoyl)propyl]cyclohexanecarboxamide CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-(4-thiazolylmethylamino)butan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2S)-4-methylsulfanyl-1-oxo-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1S)-3-(methylthio)-1-(thiazol-4-ylmethylcarbamoyl)propyl]cyclohexanecarboxamide Formula: C16H25N3O2S2 MolecularWeight: 355.5186

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CSC=N1)NC(=O)C2CCCCC2

Isomeric SMILES

CSCC[C@@H](C(=O)NCC1=CSC=N1)NC(=O)C2CCCCC2

InChI

InChI=1S/C16H25N3O2S2/c1-22-8-7-14(16(21)17-9-13-10-23-11-18-13)19-15(20)12-5-3-2-4-6-12/h10-12,14H,2-9H2,1H3,(H,17,21)(H,19,20)/t14-/m0/s1