(2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[4-(2-methylpropanoylamino)phenyl]butanamide

Systemtic Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[4-(2-methylpropanoylamino)phenyl]butanamide Openeye Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[4-(2-methylpropanoylamino)phenyl]butanamide CAS Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]butanamide IUPAC Name: (2S)-2-[(4-bromophenyl)sulfonylamino]-3-methyl-N-[4-(2-methylpropanoylamino)phenyl]butanamide Traditional Name: (2S)-2-(brosylamino)-N-[4-(isobutyrylamino)phenyl]-3-methyl-butyramide Formula: C21H26BrN3O4S MolecularWeight: 496.41784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)NC(=O)C(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)C(C)C)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C21H26BrN3O4S/c1-13(2)19(25-30(28,29)18-11-5-15(22)6-12-18)21(27)24-17-9-7-16(8-10-17)23-20(26)14(3)4/h5-14,19,25H,1-4H3,(H,23,26)(H,24,27)/t19-/m0/s1