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

Systemtic Name: 4-[4-chloranyl-7-methyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Openeye Name: 4-[4-chloro-7-methyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine CAS Name: 4-[4-chloro-7-methyl-2-[2-(methylthio)phenyl]-1H-indol-3-yl]-1-butanamine IUPAC Name: 4-[4-chloro-7-methyl-2-(2-methylsulfanylphenyl)-1H-indol-3-yl]butan-1-amine Traditional Name: 4-[4-chloro-7-methyl-2-[2-(methylthio)phenyl]-1H-indol-3-yl]butylamine Formula: C20H23ClN2S MolecularWeight: 358.92802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)C(=C(N2)C3=CC=CC=C3SC)CCCCN

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)C(=C(N2)C3=CC=CC=C3SC)CCCCN

InChI

InChI=1S/C20H23ClN2S/c1-13-10-11-16(21)18-15(8-5-6-12-22)20(23-19(13)18)14-7-3-4-9-17(14)24-2/h3-4,7,9-11,23H,5-6,8,12,22H2,1-2H3