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

Systemtic Name: 6-methoxy-N-[3-[methyl-(phenylmethyl)amino]propyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-methoxy-N-[3-[methyl-(phenylmethyl)amino]propyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=C(C2=C(N1)C=C(C=C2)OC)SC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)C1=C(C2=C(N1)C=C(C=C2)OC)SC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-30(19-20-10-5-3-6-11-20)17-9-16-28-27(31)25-26(33-22-12-7-4-8-13-22)23-15-14-21(32-2)18-24(23)29-25/h3-8,10-15,18,29H,9,16-17,19H2,1-2H3,(H,28,31)