3,6-bis(chloranyl)-N-[(5-oxidanylnaphthalen-1-yl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(5-oxidanylnaphthalen-1-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(5-hydroxy-1-naphthyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[[(5-hydroxy-1-naphthalenyl)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(5-hydroxynaphthalen-1-yl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(5-hydroxy-1-naphthyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C20H12Cl2N2O2S2 MolecularWeight: 447.35748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2O)C(=C1)NC(=S)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=CC=C2O)C(=C1)NC(=S)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H12Cl2N2O2S2/c21-10-7-8-13-16(9-10)28-18(17(13)22)19(26)24-20(27)23-14-5-1-4-12-11(14)3-2-6-15(12)25/h1-9,25H,(H2,23,24,26,27)