methyl N-[[2-(butylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(butylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(butylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-(butylamino)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(butylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(butylamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1NC(=S)NC(=O)OC

Isomeric SMILES

CCCCNC1=CC=CC=C1NC(=S)NC(=O)OC

InChI

InChI=1S/C13H19N3O2S/c1-3-4-9-14-10-7-5-6-8-11(10)15-12(19)16-13(17)18-2/h5-8,14H,3-4,9H2,1-2H3,(H2,15,16,17,19)