methyl N-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)carbamothioylamino]carbamate CAS Name: N-[[[[(3-chloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[(3-chloro-6-methoxy-1-benzothiophene-2-carbonyl)carbamothioylamino]carbamate Traditional Name: N-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)thiocarbamoylamino]carbamic acid methyl ester Formula: C13H12ClN3O4S2 MolecularWeight: 373.83508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)OC)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)OC)Cl

InChI

InChI=1S/C13H12ClN3O4S2/c1-20-6-3-4-7-8(5-6)23-10(9(7)14)11(18)15-12(22)16-17-13(19)21-2/h3-5H,1-2H3,(H,17,19)(H2,15,16,18,22)