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

Systemtic Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: N-[3-[benzyl(ethyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: N-[3-[ethyl-(phenylmethyl)amino]propyl]-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: N-[3-[benzyl(ethyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: N-[3-[benzyl(ethyl)amino]propyl]-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O2S/c1-3-31(20-21-11-6-4-7-12-21)18-10-17-29-28(32)26-27(34-23-13-8-5-9-14-23)24-16-15-22(33-2)19-25(24)30-26/h4-9,11-16,19,30H,3,10,17-18,20H2,1-2H3,(H,29,32)