3-chloranyl-N2,N6-bis[3-(dimethylamino)propyl]-N2,N6-diphenyl-1-benzothiophene-2,6-dicarboxamide

Systemtic Name: 3-chloranyl-N2,N6-bis[3-(dimethylamino)propyl]-N2,N6-diphenyl-1-benzothiophene-2,6-dicarboxamide Openeye Name: 3-chloro-N2,N6-bis[3-(dimethylamino)propyl]-N2,N6-diphenyl-benzothiophene-2,6-dicarboxamide CAS Name: 3-chloro-N2,N6-bis[3-(dimethylamino)propyl]-N2,N6-diphenyl-1-benzothiophene-2,6-dicarboxamide IUPAC Name: 3-chloro-2-N,6-N-bis[3-(dimethylamino)propyl]-2-N,6-N-diphenyl-1-benzothiophene-2,6-dicarboxamide Traditional Name: 3-chloro-N,N'-bis[3-(dimethylamino)propyl]-N,N'-diphenyl-benzothiophene-2,6-dicarboxamide Formula: C32H37ClN4O2S MolecularWeight: 577.17978

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=C(S3)C(=O)N(CCCN(C)C)C4=CC=CC=C4)Cl

Isomeric SMILES

CN(C)CCCN(C1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=C(S3)C(=O)N(CCCN(C)C)C4=CC=CC=C4)Cl

InChI

InChI=1S/C32H37ClN4O2S/c1-34(2)19-11-21-36(25-13-7-5-8-14-25)31(38)24-17-18-27-28(23-24)40-30(29(27)33)32(39)37(22-12-20-35(3)4)26-15-9-6-10-16-26/h5-10,13-18,23H,11-12,19-22H2,1-4H3