[3-[[2-chloranylprop-2-enyl(methyl)carbamothioyl]amino]phenyl] N-butylcarbamate

Systemtic Name: [3-[[2-chloranylprop-2-enyl(methyl)carbamothioyl]amino]phenyl] N-butylcarbamate Openeye Name: [3-[[2-chloroallyl(methyl)carbamothioyl]amino]phenyl] N-butylcarbamate CAS Name: N-butylcarbamic acid [3-[[[2-chloroprop-2-enyl(methyl)amino]-sulfanylidenemethyl]amino]phenyl] ester IUPAC Name: [3-[[2-chloroprop-2-enyl(methyl)carbamothioyl]amino]phenyl] N-butylcarbamate Traditional Name: N-butylcarbamic acid [3-[[2-chloroallyl(methyl)thiocarbamoyl]amino]phenyl] ester Formula: C16H22ClN3O2S MolecularWeight: 355.88278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OC1=CC=CC(=C1)NC(=S)N(C)CC(=C)Cl

Isomeric SMILES

CCCCNC(=O)OC1=CC=CC(=C1)NC(=S)N(C)CC(=C)Cl

InChI

InChI=1S/C16H22ClN3O2S/c1-4-5-9-18-16(21)22-14-8-6-7-13(10-14)19-15(23)20(3)11-12(2)17/h6-8,10H,2,4-5,9,11H2,1,3H3,(H,18,21)(H,19,23)