N-(4-bromanyl-3-chloranyl-phenyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-bromanyl-3-chloranyl-phenyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-bromo-3-chloro-phenyl)-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(4-bromo-3-chlorophenyl)-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(4-bromo-3-chlorophenyl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(4-bromo-3-chloro-phenyl)-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C18H18BrClN2O3S MolecularWeight: 457.76912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C18H18BrClN2O3S/c1-12-4-6-14(26(24,25)22-8-2-3-9-22)11-15(12)18(23)21-13-5-7-16(19)17(20)10-13/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,23)