(2S)-2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-oxidanylidene-chromen-7-yl)propanamide

Systemtic Name: (2S)-2-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-oxidanylidene-chromen-7-yl)propanamide Openeye Name: (2S)-2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(4-methyl-2-oxo-chromen-7-yl)propanamide CAS Name: (2S)-2-(4-bromo-5-methyl-1-pyrazolyl)-N-(4-methyl-2-oxo-1-benzopyran-7-yl)propanamide IUPAC Name: (2S)-2-(4-bromo-5-methylpyrazol-1-yl)-N-(4-methyl-2-oxochromen-7-yl)propanamide Traditional Name: (2S)-2-(4-bromo-5-methyl-pyrazol-1-yl)-N-(2-keto-4-methyl-chromen-7-yl)propionamide Formula: C17H16BrN3O3 MolecularWeight: 390.23124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(C)N3C(=C(C=N3)Br)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](C)N3C(=C(C=N3)Br)C

InChI

InChI=1S/C17H16BrN3O3/c1-9-6-16(22)24-15-7-12(4-5-13(9)15)20-17(23)11(3)21-10(2)14(18)8-19-21/h4-8,11H,1-3H3,(H,20,23)/t11-/m0/s1