2-[(4-bromophenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[(4-bromophenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[(4-bromophenyl)methyl-methyl-amino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 2-[(4-bromophenyl)methyl-methylamino]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[(4-bromophenyl)methyl-methylamino]-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(4-bromobenzyl)-methyl-amino]-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)N(C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)N(C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O3S/c1-16(24(2)15-17-5-7-18(22)8-6-17)21(26)23-19-9-11-20(12-10-19)29(27,28)25-13-3-4-14-25/h5-12,16H,3-4,13-15H2,1-2H3,(H,23,26)