4-bromanyl-N-[(2S)-1-[(3-ethynylphenyl)amino]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[(2S)-1-[(3-ethynylphenyl)amino]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 4-bromo-N-[(1S)-2-(3-ethynylanilino)-1-methyl-2-oxo-ethyl]benzamide CAS Name: 4-bromo-N-[(2S)-1-(3-ethynylanilino)-1-oxopropan-2-yl]benzamide IUPAC Name: 4-bromo-N-[(2S)-1-(3-ethynylanilino)-1-oxopropan-2-yl]benzamide Traditional Name: 4-bromo-N-[(1S)-2-(3-ethynylanilino)-2-keto-1-methyl-ethyl]benzamide Formula: C18H15BrN2O2 MolecularWeight: 371.2279

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrN2O2/c1-3-13-5-4-6-16(11-13)21-17(22)12(2)20-18(23)14-7-9-15(19)10-8-14/h1,4-12H,2H3,(H,20,23)(H,21,22)/t12-/m0/s1