3,6-bis(chloranyl)-N-[4-[(dibutylamino)methyl]phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[4-[(dibutylamino)methyl]phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[4-[(dibutylamino)methyl]phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[4-[(dibutylamino)methyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[4-[(dibutylamino)methyl]phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[4-[(dibutylamino)methyl]phenyl]benzothiophene-2-carboxamide Formula: C24H28Cl2N2OS MolecularWeight: 463.46292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCN(CCCC)CC1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C24H28Cl2N2OS/c1-3-5-13-28(14-6-4-2)16-17-7-10-19(11-8-17)27-24(29)23-22(26)20-12-9-18(25)15-21(20)30-23/h7-12,15H,3-6,13-14,16H2,1-2H3,(H,27,29)