methyl 4-[3-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]sulfanylbutanoate

Systemtic Name: methyl 4-[3-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]sulfanylbutanoate Openeye Name: methyl 4-[3-(1-naphthylmethyl)imidazo[1,2-a]pyridin-2-yl]sulfanylbutanoate CAS Name: 4-[[3-(1-naphthalenylmethyl)-2-imidazo[1,2-a]pyridinyl]thio]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyridin-2-yl]sulfanylbutanoate Traditional Name: 4-[[3-(1-naphthylmethyl)imidazo[1,2-a]pyridin-2-yl]thio]butyric acid methyl ester Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=C(N2C=CC=CC2=N1)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)CCCSC1=C(N2C=CC=CC2=N1)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H22N2O2S/c1-27-22(26)13-7-15-28-23-20(25-14-5-4-12-21(25)24-23)16-18-10-6-9-17-8-2-3-11-19(17)18/h2-6,8-12,14H,7,13,15-16H2,1H3