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

Systemtic Name: methyl N-[[2-(butanoylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(butanoylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-(1-oxobutylamino)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(butanoylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[(2-butyramidophenyl)thiocarbamoyl]carbamic acid methyl ester Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC=C1NC(=S)NC(=O)OC

Isomeric SMILES

CCCC(=O)NC1=CC=CC=C1NC(=S)NC(=O)OC

InChI

InChI=1S/C13H17N3O3S/c1-3-6-11(17)14-9-7-4-5-8-10(9)15-12(20)16-13(18)19-2/h4-5,7-8H,3,6H2,1-2H3,(H,14,17)(H2,15,16,18,20)