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

Systemtic Name: 2-bromanyl-N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-bromo-N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-bromo-N-(2-methyl-1,3-benzoxazol-5-yl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-bromo-N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-bromo-N-(2-methyl-1,3-benzoxazol-5-yl)-5-pyrrolidinosulfonyl-benzamide Formula: C19H18BrN3O4S MolecularWeight: 464.33292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Br

InChI

InChI=1S/C19H18BrN3O4S/c1-12-21-17-10-13(4-7-18(17)27-12)22-19(24)15-11-14(5-6-16(15)20)28(25,26)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,22,24)