prop-2-ynyl N-[[2-(prop-2-ynoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: prop-2-ynyl N-[[2-(prop-2-ynoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Openeye Name: prop-2-ynyl N-[[2-(prop-2-ynoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[[[oxo(prop-2-ynoxy)methyl]amino]-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]carbamic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl N-[[2-(prop-2-ynoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(propargyloxycarbonylthiocarbamoylamino)phenyl]thiocarbamoyl]carbamic acid propargyl ester Formula: C16H14N4O4S2 MolecularWeight: 390.43676

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OCC#C

Isomeric SMILES

C#CCOC(=O)NC(=S)NC1=CC=CC=C1NC(=S)NC(=O)OCC#C

InChI

InChI=1S/C16H14N4O4S2/c1-3-9-23-15(21)19-13(25)17-11-7-5-6-8-12(11)18-14(26)20-16(22)24-10-4-2/h1-2,5-8H,9-10H2,(H2,17,19,21,25)(H2,18,20,22,26)