N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-tosyl-pyrrolidine-2-carboxamide Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

InChI

InChI=1S/C24H23N3O3S2/c1-16-9-12-18(13-10-16)32(29,30)27-15-5-8-20(27)23(28)25-24-26(2)22-19-7-4-3-6-17(19)11-14-21(22)31-24/h3-4,6-7,9-14,20H,5,8,15H2,1-2H3