ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-propylsulfinyl-phenyl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-propylsulfinyl-phenyl]carbamothioyl]carbamate Openeye Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-propylsulfinyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-4-propylsulfinylanilino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-propylsulfinylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(carbethoxythiocarbamoylamino)-4-propylsulfinyl-phenyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C17H24N4O5S3 MolecularWeight: 460.59126

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)C1=CC(=C(C=C1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

Isomeric SMILES

CCCS(=O)C1=CC(=C(C=C1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

InChI

InChI=1S/C17H24N4O5S3/c1-4-9-29(24)11-7-8-12(18-14(27)20-16(22)25-5-2)13(10-11)19-15(28)21-17(23)26-6-3/h7-8,10H,4-6,9H2,1-3H3,(H2,18,20,22,27)(H2,19,21,23,28)