3-chloranyl-6-methoxy-N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methoxy-N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methoxy-N-[[[2-(4-methoxyphenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methoxy-N-[[[2-(4-methoxyphenyl)acetyl]amino]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C20H18ClN3O4S2 MolecularWeight: 463.95762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NNC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NNC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)OC)Cl

InChI

InChI=1S/C20H18ClN3O4S2/c1-27-12-5-3-11(4-6-12)9-16(25)23-24-20(29)22-19(26)18-17(21)14-8-7-13(28-2)10-15(14)30-18/h3-8,10H,9H2,1-2H3,(H,23,25)(H2,22,24,26,29)