[(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 5-bromanyl-1H-indole-3-carboxylate

Systemtic Name: [(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl] 5-bromanyl-1H-indole-3-carboxylate Openeye Name: [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] 5-bromo-1H-indole-3-carboxylate CAS Name: 5-bromo-1H-indole-3-carboxylic acid [(2S)-1-[(5-methyl-3-isoxazolyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [(2S)-1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxobutan-2-yl] 5-bromo-1H-indole-3-carboxylate Traditional Name: 5-bromo-1H-indole-3-carboxylic acid [(1S)-1-[(5-methylisoxazol-3-yl)carbamoyl]propyl] ester Formula: C17H16BrN3O4 MolecularWeight: 406.23064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)OC(=O)C2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

CC[C@@H](C(=O)NC1=NOC(=C1)C)OC(=O)C2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C17H16BrN3O4/c1-3-14(16(22)20-15-6-9(2)25-21-15)24-17(23)12-8-19-13-5-4-10(18)7-11(12)13/h4-8,14,19H,3H2,1-2H3,(H,20,21,22)/t14-/m0/s1