N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]-1-benzothiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]benzothiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-6-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]benzothiophene-2-carboxamide Formula: C27H26N4OS MolecularWeight: 454.58654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CCNCC3=CC4=C(C=C3)C=C(S4)C(=O)NC5=CC=CC=C5N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CCNCC3=CC4=C(C=C3)C=C(S4)C(=O)NC5=CC=CC=C5N

InChI

InChI=1S/C27H26N4OS/c1-17-20(21-6-2-4-8-23(21)30-17)12-13-29-16-18-10-11-19-15-26(33-25(19)14-18)27(32)31-24-9-5-3-7-22(24)28/h2-11,14-15,29-30H,12-13,16,28H2,1H3,(H,31,32)