ethyl 4-[2-ethyl-6-methyl-1-(phenylmethyl)indol-5-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[2-ethyl-6-methyl-1-(phenylmethyl)indol-5-yl]sulfanylbutanoate Openeye Name: ethyl 4-(1-benzyl-2-ethyl-6-methyl-indol-5-yl)sulfanylbutanoate CAS Name: 4-[[2-ethyl-6-methyl-1-(phenylmethyl)-5-indolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-(1-benzyl-2-ethyl-6-methylindol-5-yl)sulfanylbutanoate Traditional Name: 4-[(1-benzyl-2-ethyl-6-methyl-indol-5-yl)thio]butyric acid ethyl ester Formula: C24H29NO2S MolecularWeight: 395.55756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC(=C(C=C2N1CC3=CC=CC=C3)C)SCCCC(=O)OCC

Isomeric SMILES

CCC1=CC2=CC(=C(C=C2N1CC3=CC=CC=C3)C)SCCCC(=O)OCC

InChI

InChI=1S/C24H29NO2S/c1-4-21-15-20-16-23(28-13-9-12-24(26)27-5-2)18(3)14-22(20)25(21)17-19-10-7-6-8-11-19/h6-8,10-11,14-16H,4-5,9,12-13,17H2,1-3H3