4-azanyl-N-[2-[[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]amino]-2-oxidanylidene-ethyl]butanamide hydrobromide

Systemtic Name: 4-azanyl-N-[2-[[4-bromanyl-2-(2-chlorophenyl)carbonyl-phenyl]amino]-2-oxidanylidene-ethyl]butanamide hydrobromide Openeye Name: 4-amino-N-[2-[4-bromo-2-(2-chlorobenzoyl)anilino]-2-oxo-ethyl]butanamide hydrobromide CAS Name: 4-amino-N-[2-[4-bromo-2-[(2-chlorophenyl)-oxomethyl]anilino]-2-oxoethyl]butanamide hydrobromide IUPAC Name: 4-amino-N-[2-[4-bromo-2-(2-chlorobenzoyl)anilino]-2-oxoethyl]butanamide hydrobromide Traditional Name: 4-amino-N-[2-[4-bromo-2-(2-chlorobenzoyl)anilino]-2-keto-ethyl]butyramide hydrobromide Formula: C19H20Br2ClN3O3 MolecularWeight: 533.6414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CNC(=O)CCCN)Cl.Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)CNC(=O)CCCN)Cl.Br

InChI

InChI=1S/C19H19BrClN3O3.BrH/c20-12-7-8-16(24-18(26)11-23-17(25)6-3-9-22)14(10-12)19(27)13-4-1-2-5-15(13)21;/h1-2,4-5,7-8,10H,3,6,9,11,22H2,(H,23,25)(H,24,26);1H