6-[[(phenylmethyl)amino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide

Systemtic Name: 6-[[(phenylmethyl)amino]methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: 6-[(benzylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-[[(phenylmethyl)amino]methyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: 6-[(benzylamino)methyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: 6-[(benzylamino)methyl]-3-(phenylthio)-1H-indole-2-carboxamide Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3OS/c24-23(27)21-22(28-18-9-5-2-6-10-18)19-12-11-17(13-20(19)26-21)15-25-14-16-7-3-1-4-8-16/h1-13,25-26H,14-15H2,(H2,24,27)