4-[7-ethyl-2-(2-methoxy-5-methylsulfanyl-phenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[7-ethyl-2-(2-methoxy-5-methylsulfanyl-phenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[7-ethyl-2-(2-methoxy-5-methylsulfanyl-phenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[7-ethyl-2-[2-methoxy-5-(methylthio)phenyl]-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[7-ethyl-2-(2-methoxy-5-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[7-ethyl-2-[2-methoxy-5-(methylthio)phenyl]-1H-indol-3-yl]butylamine Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC(=C2CCCCN)C3=C(C=CC(=C3)SC)OC

Isomeric SMILES

CCC1=CC=CC2=C1NC(=C2CCCCN)C3=C(C=CC(=C3)SC)OC

InChI

InChI=1S/C22H28N2OS/c1-4-15-8-7-10-17-18(9-5-6-13-23)22(24-21(15)17)19-14-16(26-3)11-12-20(19)25-2/h7-8,10-12,14,24H,4-6,9,13,23H2,1-3H3