6-[[(4-dimethylaminophenyl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 6-[[(4-dimethylaminophenyl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 6-[[(4-dimethylaminophenyl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-[[(4-dimethylaminophenyl)methylamino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 6-[[(4-dimethylaminophenyl)methylamino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 6-[[[4-(dimethylamino)benzyl]amino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNCC2=CC3=C(C=C2)C(=C(N3)C(=O)N)SC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNCC2=CC3=C(C=C2)C(=C(N3)C(=O)N)SC4=CC=CC=C4

InChI

InChI=1S/C25H26N4OS/c1-29(2)19-11-8-17(9-12-19)15-27-16-18-10-13-21-22(14-18)28-23(25(26)30)24(21)31-20-6-4-3-5-7-20/h3-14,27-28H,15-16H2,1-2H3,(H2,26,30)