2-bromanyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-bromanyl-N-(6-methyl-1,3-benzothiazol-2-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(6-methyl-1,3-benzothiazol-2-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-(6-methyl-1,3-benzothiazol-2-yl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(6-methyl-1,3-benzothiazol-2-yl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(6-methyl-1,3-benzothiazol-2-yl)-5-pyrrolidinosulfonyl-benzamide Formula: C19H18BrN3O3S2 MolecularWeight: 480.39852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

InChI

InChI=1S/C19H18BrN3O3S2/c1-12-4-7-16-17(10-12)27-19(21-16)22-18(24)14-11-13(5-6-15(14)20)28(25,26)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,22,24)