3-chloranyl-6-methoxy-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methoxy-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methoxy-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methoxy-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methoxy-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methoxy-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C23H18ClN3O3S2 MolecularWeight: 483.99032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)CC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)CC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C23H18ClN3O3S2/c1-30-15-9-10-17-18(12-15)32-21(20(17)24)22(29)25-23(31)27-26-19(28)11-14-7-4-6-13-5-2-3-8-16(13)14/h2-10,12H,11H2,1H3,(H,26,28)(H2,25,27,29,31)