(2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]butanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]butanamide Openeye Name: (2S)-N-(1-benzylpyrrolidin-3-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]butanamide IUPAC Name: (2S)-N-(1-benzylpyrrolidin-3-yl)-2-[(4-bromophenyl)sulfonylamino]-3-methylbutanamide Traditional Name: (2S)-N-(1-benzylpyrrolidin-3-yl)-2-(brosylamino)-3-methyl-butyramide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCN(C1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CCN(C1)CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H28BrN3O3S/c1-16(2)21(25-30(28,29)20-10-8-18(23)9-11-20)22(27)24-19-12-13-26(15-19)14-17-6-4-3-5-7-17/h3-11,16,19,21,25H,12-15H2,1-2H3,(H,24,27)/t19?,21-/m0/s1