4-[5-ethoxy-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[5-ethoxy-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[5-ethoxy-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-ethoxy-2-[2-(methylthio)phenyl]-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-ethoxy-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[5-ethoxy-2-[2-(methylthio)phenyl]-1H-indol-3-yl]butylamine Formula: C21H26N2OS MolecularWeight: 354.50894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=CC=CC=C3SC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=C2CCCCN)C3=CC=CC=C3SC

InChI

InChI=1S/C21H26N2OS/c1-3-24-15-11-12-19-18(14-15)16(8-6-7-13-22)21(23-19)17-9-4-5-10-20(17)25-2/h4-5,9-12,14,23H,3,6-8,13,22H2,1-2H3