ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)pyridin-3-yl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)pyridin-3-yl]carbamothioyl]carbamate Openeye Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-3-pyridyl]carbamothioyl]carbamate CAS Name: N-[[[2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-3-pyridinyl]amino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)pyridin-3-yl]carbamothioyl]carbamate Traditional Name: N-[[2-(carbethoxythiocarbamoylamino)-3-pyridyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C13H17N5O4S2 MolecularWeight: 371.43518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=C(N=CC=C1)NC(=S)NC(=O)OCC

Isomeric SMILES

CCOC(=O)NC(=S)NC1=C(N=CC=C1)NC(=S)NC(=O)OCC

InChI

InChI=1S/C13H17N5O4S2/c1-3-21-12(19)17-10(23)15-8-6-5-7-14-9(8)16-11(24)18-13(20)22-4-2/h5-7H,3-4H2,1-2H3,(H2,15,17,19,23)(H2,14,16,18,20,24)