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

Systemtic Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonyl-ethanamide Openeye Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfonyl-acetamide CAS Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfonylacetamide IUPAC Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfonylacetamide Traditional Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-(2-keto-2-pyrrolidino-ethyl)sulfonyl-acetamide Formula: C17H21N3O4S2 MolecularWeight: 395.49634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCCC3)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)CS(=O)(=O)CC(=O)N3CCCC3)S2)C

InChI

InChI=1S/C17H21N3O4S2/c1-12-5-6-13-14(9-12)25-17(19(13)2)18-15(21)10-26(23,24)11-16(22)20-7-3-4-8-20/h5-6,9H,3-4,7-8,10-11H2,1-2H3