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

Systemtic Name: 4-[5-butan-2-yl-2-(2-methoxy-5-methylsulfanyl-phenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[2-(2-methoxy-5-methylsulfanyl-phenyl)-5-sec-butyl-1H-indol-3-yl]butan-1-amine CAS Name: 4-[5-butan-2-yl-2-[2-methoxy-5-(methylthio)phenyl]-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[5-butan-2-yl-2-(2-methoxy-5-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[2-[2-methoxy-5-(methylthio)phenyl]-5-sec-butyl-1H-indol-3-yl]butylamine Formula: C24H32N2OS MolecularWeight: 396.58868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)SC)OC

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CCCCN)C3=C(C=CC(=C3)SC)OC

InChI

InChI=1S/C24H32N2OS/c1-5-16(2)17-9-11-22-20(14-17)19(8-6-7-13-25)24(26-22)21-15-18(28-4)10-12-23(21)27-3/h9-12,14-16,26H,5-8,13,25H2,1-4H3