2-[(4-bromanyl-2-methyl-phenyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(4-bromo-2-methyl-anilino)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(4-bromo-2-methylanilino)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-2-methylanilino)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-bromo-2-methyl-anilino)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C19H22BrN3O3S MolecularWeight: 452.36528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H22BrN3O3S/c1-14-11-15(20)7-8-18(14)21-13-19(24)22-16-5-4-6-17(12-16)27(25,26)23-9-2-3-10-23/h4-8,11-12,21H,2-3,9-10,13H2,1H3,(H,22,24)