N-[(4-butoxyphenyl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(4-butoxyphenyl)carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-butoxyphenyl)carbamothioyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[(4-butoxyanilino)-sulfanylidenemethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-butoxyphenyl)carbamothioyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-butoxyphenyl)thiocarbamoyl]-3-chloro-benzothiophene-2-carboxamide Formula: C20H19ClN2O2S2 MolecularWeight: 418.96006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H19ClN2O2S2/c1-2-3-12-25-14-10-8-13(9-11-14)22-20(26)23-19(24)18-17(21)15-6-4-5-7-16(15)27-18/h4-11H,2-3,12H2,1H3,(H2,22,23,24,26)