4-[4,7-dimethyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine

Systemtic Name: 4-[4,7-dimethyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4,7-dimethyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4,7-dimethyl-2-[2-(methylthio)phenyl]-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4,7-dimethyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4,7-dimethyl-2-[2-(methylthio)phenyl]-1H-indol-3-yl]butylamine Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(NC2=C(C=C1)C)C3=CC=CC=C3SC)CCCCN

Isomeric SMILES

CC1=C2C(=C(NC2=C(C=C1)C)C3=CC=CC=C3SC)CCCCN

InChI

InChI=1S/C21H26N2S/c1-14-11-12-15(2)20-19(14)17(9-6-7-13-22)21(23-20)16-8-4-5-10-18(16)24-3/h4-5,8,10-12,23H,6-7,9,13,22H2,1-3H3