ethyl N-[(4-butylphenyl)carbamothioylamino]carbamate

Systemtic Name: ethyl N-[(4-butylphenyl)carbamothioylamino]carbamate Openeye Name: ethyl N-[(4-butylphenyl)carbamothioylamino]carbamate CAS Name: N-[[(4-butylanilino)-sulfanylidenemethyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[(4-butylphenyl)carbamothioylamino]carbamate Traditional Name: N-[(4-butylphenyl)thiocarbamoylamino]carbamic acid ethyl ester Formula: C14H21N3O2S MolecularWeight: 295.40044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2S/c1-3-5-6-11-7-9-12(10-8-11)15-13(20)16-17-14(18)19-4-2/h7-10H,3-6H2,1-2H3,(H,17,18)(H2,15,16,20)