(phenylmethyl) N-[1-[(4-diazenyl-3-oxidanylidene-1-sulfanyl-butan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[(4-diazenyl-3-oxidanylidene-1-sulfanyl-butan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: benzyl N-[1-benzyl-2-[[3-diazenyl-2-oxo-1-(sulfanylmethyl)propyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[(4-diazenyl-1-mercapto-3-oxobutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[(4-diazenyl-3-oxo-1-sulfanylbutan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[[3-diazenyl-2-keto-1-(mercaptomethyl)propyl]amino]-2-keto-ethyl]carbamic acid benzyl ester Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CS)C(=O)CN=N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CS)C(=O)CN=N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N4O4S/c22-23-12-19(26)18(14-30)24-20(27)17(11-15-7-3-1-4-8-15)25-21(28)29-13-16-9-5-2-6-10-16/h1-10,17-18,22,30H,11-14H2,(H,24,27)(H,25,28)