(phenylmethyl) N-[2-[[2-(3-nitrophenyl)carbonylphenyl]amino]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[[2-(3-nitrophenyl)carbonylphenyl]amino]-2-oxidanylidene-1-propan-2-ylsulfanyl-ethyl]carbamate Openeye Name: benzyl N-[1-isopropylsulfanyl-2-[2-(3-nitrobenzoyl)anilino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[2-[(3-nitrophenyl)-oxomethyl]anilino]-2-oxo-1-(propan-2-ylthio)ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[2-(3-nitrobenzoyl)anilino]-2-oxo-1-propan-2-ylsulfanylethyl]carbamate Traditional Name: N-[1-(isopropylthio)-2-keto-2-[2-(3-nitrobenzoyl)anilino]ethyl]carbamic acid benzyl ester Formula: C26H25N3O6S MolecularWeight: 507.5582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(C(=O)NC1=CC=CC=C1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)SC(C(=O)NC1=CC=CC=C1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H25N3O6S/c1-17(2)36-25(28-26(32)35-16-18-9-4-3-5-10-18)24(31)27-22-14-7-6-13-21(22)23(30)19-11-8-12-20(15-19)29(33)34/h3-15,17,25H,16H2,1-2H3,(H,27,31)(H,28,32)