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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(o-tolyl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-(2-methylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-(o-tolyl)-3-pyrrolidinosulfonyl-benzamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC=CC=C1N(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H23N3O3S2/c1-18-9-2-4-13-22(18)28(25-26-21-12-3-5-14-23(21)32-25)24(29)19-10-8-11-20(17-19)33(30,31)27-15-6-7-16-27/h2-5,8-14,17H,6-7,15-16H2,1H3