propan-2-yl N-[3,4-bis(methoxycarbonylcarbamothioylamino)phenyl]carbamate

Systemtic Name: propan-2-yl N-[3,4-bis(methoxycarbonylcarbamothioylamino)phenyl]carbamate Openeye Name: isopropyl N-[3,4-bis(methoxycarbonylcarbamothioylamino)phenyl]carbamate CAS Name: N-[3,4-bis[[(methoxycarbonylamino)-sulfanylidenemethyl]amino]phenyl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[3,4-bis(methoxycarbonylcarbamothioylamino)phenyl]carbamate Traditional Name: N-[3,4-bis(carbomethoxythiocarbamoylamino)phenyl]carbamic acid isopropyl ester Formula: C16H21N5O6S2 MolecularWeight: 443.49784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=S)NC(=O)OC

Isomeric SMILES

CC(C)OC(=O)NC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=S)NC(=O)OC

InChI

InChI=1S/C16H21N5O6S2/c1-8(2)27-16(24)17-9-5-6-10(18-12(28)20-14(22)25-3)11(7-9)19-13(29)21-15(23)26-4/h5-8H,1-4H3,(H,17,24)(H2,18,20,22,28)(H2,19,21,23,29)