methyl 4-(1-methylindol-2-yl)sulfanylbutanoate

Systemtic Name: methyl 4-(1-methylindol-2-yl)sulfanylbutanoate Openeye Name: methyl 4-(1-methylindol-2-yl)sulfanylbutanoate CAS Name: 4-[(1-methyl-2-indolyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(1-methylindol-2-yl)sulfanylbutanoate Traditional Name: 4-[(1-methylindol-2-yl)thio]butyric acid methyl ester Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1SCCCC(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2C=C1SCCCC(=O)OC

InChI

InChI=1S/C14H17NO2S/c1-15-12-7-4-3-6-11(12)10-13(15)18-9-5-8-14(16)17-2/h3-4,6-7,10H,5,8-9H2,1-2H3