1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-[3-(2-methoxyethyl)-5-nitro-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide Formula: C21H21ClN4O6S2 MolecularWeight: 524.99764

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COCCN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4O6S2/c1-32-12-11-24-18-13-15(26(28)29)6-9-19(18)33-21(24)23-20(27)17-3-2-10-25(17)34(30,31)16-7-4-14(22)5-8-16/h4-9,13,17H,2-3,10-12H2,1H3