O-propyl N-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]carbamothioate

Systemtic Name: O-propyl N-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]carbamothioate Openeye Name: O-propyl N-(3-chlorobenzothiophene-2-carbonyl)carbamothioate CAS Name: N-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]carbamothioic acid O-propyl ester IUPAC Name: O-propyl N-(3-chloro-1-benzothiophene-2-carbonyl)carbamothioate Traditional Name: N-(3-chlorobenzothiophene-2-carbonyl)thiocarbamic acid O-propyl ester Formula: C13H12ClNO2S2 MolecularWeight: 313.82288

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=S)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CCCOC(=S)NC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C13H12ClNO2S2/c1-2-7-17-13(18)15-12(16)11-10(14)8-5-3-4-6-9(8)19-11/h3-6H,2,7H2,1H3,(H,15,16,18)