N-cyclohexyl-2-[2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]-2-oxoethyl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[2-keto-2-[(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)amino]ethyl]thio]acetamide Formula: C18H22N4O4S2 MolecularWeight: 422.52168

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)NC3CCCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)NC3CCCCC3

InChI

InChI=1S/C18H22N4O4S2/c1-21-14-8-7-13(22(25)26)9-15(14)28-18(21)20-17(24)11-27-10-16(23)19-12-5-3-2-4-6-12/h7-9,12H,2-6,10-11H2,1H3,(H,19,23)