1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Openeye Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Traditional Name: 1-(4-methoxyphenyl)sulfonyl-N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]pyrrolidine-2-carboxamide Formula: C21H23N3O4S3 MolecularWeight: 477.62002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H23N3O4S3/c1-23-17-11-8-15(29-3)13-19(17)30-21(23)22-20(25)18-5-4-12-24(18)31(26,27)16-9-6-14(28-2)7-10-16/h6-11,13,18H,4-5,12H2,1-3H3