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

Systemtic Name: ethyl N-[[4-butyl-2-(ethoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Openeye Name: ethyl N-[[4-butyl-2-(ethoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[4-butyl-2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]anilino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[4-butyl-2-(ethoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[4-butyl-2-(carbethoxythiocarbamoylamino)phenyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C18H26N4O4S2 MolecularWeight: 426.55344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

InChI

InChI=1S/C18H26N4O4S2/c1-4-7-8-12-9-10-13(19-15(27)21-17(23)25-5-2)14(11-12)20-16(28)22-18(24)26-6-3/h9-11H,4-8H2,1-3H3,(H2,19,21,23,27)(H2,20,22,24,28)