[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-1-oxopropan-2-yl] 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid (2-keto-1-methyl-2-ureido-ethyl) ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OC(C)C(=O)NC(=O)N

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OC(C)C(=O)NC(=O)N

InChI

InChI=1S/C16H21N3O5S/c1-9(2)18-13(20)8-25-12-7-5-4-6-11(12)15(22)24-10(3)14(21)19-16(17)23/h4-7,9-10H,8H2,1-3H3,(H,18,20)(H3,17,19,21,23)