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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCC3

Isomeric SMILES

CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCC3

InChI

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