N-[1-[2-(2-bromophenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[1-[2-(2-bromophenyl)carbonylhydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-phenoxy-ethanamide Openeye Name: N-[1-[[(2-bromobenzoyl)amino]carbamoyl]-3-methylsulfanyl-propyl]-2-phenoxy-acetamide CAS Name: N-[1-[[(2-bromophenyl)-oxomethyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-phenoxyacetamide IUPAC Name: N-[1-[2-(2-bromobenzoyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-phenoxyacetamide Traditional Name: N-[1-[[(2-bromobenzoyl)amino]carbamoyl]-3-(methylthio)propyl]-2-phenoxy-acetamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C1=CC=CC=C1Br)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)NNC(=O)C1=CC=CC=C1Br)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H22BrN3O4S/c1-29-12-11-17(22-18(25)13-28-14-7-3-2-4-8-14)20(27)24-23-19(26)15-9-5-6-10-16(15)21/h2-10,17H,11-13H2,1H3,(H,22,25)(H,23,26)(H,24,27)