methyl N-[[2-(butoxyamino)-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(butoxyamino)-5-(phenylcarbonyl)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[5-benzoyl-2-(butoxyamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[5-benzoyl-2-(butoxyamino)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[5-benzoyl-2-(butoxyamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[5-benzoyl-2-(butoxyamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCONC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC

Isomeric SMILES

CCCCONC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)NC(=S)NC(=O)OC

InChI

InChI=1S/C20H23N3O4S/c1-3-4-12-27-23-16-11-10-15(18(24)14-8-6-5-7-9-14)13-17(16)21-19(28)22-20(25)26-2/h5-11,13,23H,3-4,12H2,1-2H3,(H2,21,22,25,28)