methyl 3-[7-methyl-3-(4-methylphenyl)sulfanyl-1H-indol-2-yl]propanoate

Systemtic Name: methyl 3-[7-methyl-3-(4-methylphenyl)sulfanyl-1H-indol-2-yl]propanoate Openeye Name: methyl 3-[7-methyl-3-(p-tolylsulfanyl)-1H-indol-2-yl]propanoate CAS Name: 3-[7-methyl-3-[(4-methylphenyl)thio]-1H-indol-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[7-methyl-3-(4-methylphenyl)sulfanyl-1H-indol-2-yl]propanoate Traditional Name: 3-[7-methyl-3-(p-tolylthio)-1H-indol-2-yl]propionic acid methyl ester Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(NC3=C2C=CC=C3C)CCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(NC3=C2C=CC=C3C)CCC(=O)OC

InChI

InChI=1S/C20H21NO2S/c1-13-7-9-15(10-8-13)24-20-16-6-4-5-14(2)19(16)21-17(20)11-12-18(22)23-3/h4-10,21H,11-12H2,1-3H3