methyl 3-chloranyl-6-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[[(2-methoxy-3-dibenzofuranyl)amino]-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-[(2-methoxydibenzofuran-3-yl)carbamothioylamino]-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[(2-methoxydibenzofuran-3-yl)thiocarbamoylamino]benzothiophene-2-carboxylic acid methyl ester Formula: C24H17ClN2O4S2 MolecularWeight: 496.98578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=S)NC4=CC5=C(C=C4)C(=C(S5)C(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=S)NC4=CC5=C(C=C4)C(=C(S5)C(=O)OC)Cl

InChI

InChI=1S/C24H17ClN2O4S2/c1-29-19-10-15-13-5-3-4-6-17(13)31-18(15)11-16(19)27-24(32)26-12-7-8-14-20(9-12)33-22(21(14)25)23(28)30-2/h3-11H,1-2H3,(H2,26,27,32)