(2S)-2-acetamido-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(1H-indol-3-yl)-N-methyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-3-(1H-indol-3-yl)-N-methyl-propanamide Openeye Name: (2S)-2-acetamido-N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-3-(1H-indol-3-yl)-N-methyl-propanamide CAS Name: (2S)-2-acetamido-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(1H-indol-3-yl)-N-methylpropanamide IUPAC Name: (2S)-2-acetamido-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-3-(1H-indol-3-yl)-N-methylpropanamide Traditional Name: (2S)-2-acetamido-N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-3-(1H-indol-3-yl)-N-methyl-propionamide Formula: C23H25BrN4O3 MolecularWeight: 485.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)C(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)C

InChI

InChI=1S/C23H25BrN4O3/c1-14-10-17(24)8-9-19(14)27-22(30)13-28(3)23(31)21(26-15(2)29)11-16-12-25-20-7-5-4-6-18(16)20/h4-10,12,21,25H,11,13H2,1-3H3,(H,26,29)(H,27,30)/t21-/m0/s1