N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(2,6-dimethylphenyl)-3-pyrrolidinosulfonyl-benzamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C26H25N3O3S2/c1-18-9-7-10-19(2)24(18)29(26-27-22-13-3-4-14-23(22)33-26)25(30)20-11-8-12-21(17-20)34(31,32)28-15-5-6-16-28/h3-4,7-14,17H,5-6,15-16H2,1-2H3