N-[1-(4-butan-2-ylphenyl)propyl]-3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3,7-dichloro-6-methoxy-N-[1-(4-sec-butylphenyl)propyl]benzothiophene-2-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3,7-dichloro-6-methoxy-N-[1-(4-sec-butylphenyl)propyl]benzothiophene-2-carboxamide Formula: C23H25Cl2NO2S MolecularWeight: 450.4211

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C3=C(S2)C(=C(C=C3)OC)Cl)Cl

InChI

InChI=1S/C23H25Cl2NO2S/c1-5-13(3)14-7-9-15(10-8-14)17(6-2)26-23(27)22-19(24)16-11-12-18(28-4)20(25)21(16)29-22/h7-13,17H,5-6H2,1-4H3,(H,26,27)