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

Systemtic Name: N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide Openeye Name: N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-acetamide CAS Name: N-[3-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]acetamide IUPAC Name: N-[3-(2-methoxyethyl)-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-(2-methoxyethyl)-6-nitro-1,3-benzothiazol-2-ylidene]acetamide Formula: C19H24N4O5S2 MolecularWeight: 452.54766

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCCC3

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCCC3

InChI

InChI=1S/C19H24N4O5S2/c1-28-10-9-22-15-6-5-14(23(26)27)11-16(15)30-19(22)20-17(24)12-29-13-18(25)21-7-3-2-4-8-21/h5-6,11H,2-4,7-10,12-13H2,1H3