N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide

Systemtic Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide Openeye Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-acetamide CAS Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]acetamide IUPAC Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)acetamide Formula: C17H20N4O4S2 MolecularWeight: 408.4951

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCCC3

InChI

InChI=1S/C17H20N4O4S2/c1-19-13-6-5-12(21(24)25)9-14(13)27-17(19)18-15(22)10-26-11-16(23)20-7-3-2-4-8-20/h5-6,9H,2-4,7-8,10-11H2,1H3