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

Systemtic Name: 6-methoxy-N-[3-[(phenylmethyl)-propan-2-yl-amino]propyl]-3-phenylsulfanyl-1H-indole-2-carboxamide Openeye Name: N-[3-[benzyl(isopropyl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide CAS Name: 6-methoxy-N-[3-[(phenylmethyl)-propan-2-ylamino]propyl]-3-(phenylthio)-1H-indole-2-carboxamide IUPAC Name: N-[3-[benzyl(propan-2-yl)amino]propyl]-6-methoxy-3-phenylsulfanyl-1H-indole-2-carboxamide Traditional Name: N-[3-[benzyl(isopropyl)amino]propyl]-6-methoxy-3-(phenylthio)-1H-indole-2-carboxamide Formula: C29H33N3O2S MolecularWeight: 487.65622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33N3O2S/c1-21(2)32(20-22-11-6-4-7-12-22)18-10-17-30-29(33)27-28(35-24-13-8-5-9-14-24)25-16-15-23(34-3)19-26(25)31-27/h4-9,11-16,19,21,31H,10,17-18,20H2,1-3H3,(H,30,33)