methyl N-[[2-(3-chloranylpropanoylamino)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(3-chloranylpropanoylamino)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(3-chloropropanoylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[(3-chloro-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(3-chloropropanoylamino)phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(3-chloropropanoylamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C12H14ClN3O3S MolecularWeight: 315.77586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=CC=CC=C1NC(=O)CCCl

Isomeric SMILES

COC(=O)NC(=S)NC1=CC=CC=C1NC(=O)CCCl

InChI

InChI=1S/C12H14ClN3O3S/c1-19-12(18)16-11(20)15-9-5-3-2-4-8(9)14-10(17)6-7-13/h2-5H,6-7H2,1H3,(H,14,17)(H2,15,16,18,20)