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

Systemtic Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-ethanamide Openeye Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-acetamide CAS Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]acetamide IUPAC Name: N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylacetamide Traditional Name: 2-[(2-keto-2-pyrrolidino-ethyl)thio]-N-(3-methyl-6-nitro-1,3-benzothiazol-2-ylidene)acetamide Formula: C16H18N4O4S2 MolecularWeight: 394.46852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CSCC(=O)N3CCCC3

InChI

InChI=1S/C16H18N4O4S2/c1-18-12-5-4-11(20(23)24)8-13(12)26-16(18)17-14(21)9-25-10-15(22)19-6-2-3-7-19/h4-5,8H,2-3,6-7,9-10H2,1H3