1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Openeye Name: 1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide CAS Name: 1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Traditional Name: 1-(4-chlorophenyl)sulfonyl-N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)pyrrolidine-2-carboxamide Formula: C20H20ClN3O3S2 MolecularWeight: 449.9741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Cl)S2)C

InChI

InChI=1S/C20H20ClN3O3S2/c1-13-5-10-16-18(12-13)28-20(23(16)2)22-19(25)17-4-3-11-24(17)29(26,27)15-8-6-14(21)7-9-15/h5-10,12,17H,3-4,11H2,1-2H3