(phenylmethyl) N-[1-[2-(4-bromophenyl)sulfanylethylamino]-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-(4-bromophenyl)sulfanylethylamino]-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: benzyl N-[2-[2-(4-bromophenyl)sulfanylethylamino]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[1-[2-[(4-bromophenyl)thio]ethylamino]-1-oxopropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-(4-bromophenyl)sulfanylethylamino]-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[2-[(4-bromophenyl)thio]ethylamino]-2-keto-1-methyl-ethyl]carbamic acid benzyl ester Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCSC1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCCSC1=CC=C(C=C1)Br)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H21BrN2O3S/c1-14(22-19(24)25-13-15-5-3-2-4-6-15)18(23)21-11-12-26-17-9-7-16(20)8-10-17/h2-10,14H,11-13H2,1H3,(H,21,23)(H,22,24)