(phenylmethyl) N-[1-[(1-diazenyl-5-methylsulfanyl-2-oxidanylidene-pentan-3-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[(1-diazenyl-5-methylsulfanyl-2-oxidanylidene-pentan-3-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-[[3-diazenyl-1-(2-methylsulfanylethyl)-2-oxo-propyl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[[1-diazenyl-5-(methylthio)-2-oxopentan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[(1-diazenyl-5-methylsulfanyl-2-oxopentan-3-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[[3-diazenyl-2-keto-1-[2-(methylthio)ethyl]propyl]carbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C20H30N4O4S MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCSC)C(=O)CN=N)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(C(=O)NC(CCSC)C(=O)CN=N)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C20H30N4O4S/c1-14(2)11-17(24-20(27)28-13-15-7-5-4-6-8-15)19(26)23-16(9-10-29-3)18(25)12-22-21/h4-8,14,16-17,21H,9-13H2,1-3H3,(H,23,26)(H,24,27)