ethyl 4-[2-(2-pyridin-3-ylindol-1-yl)ethylsulfanyl]benzoate

Systemtic Name: ethyl 4-[2-(2-pyridin-3-ylindol-1-yl)ethylsulfanyl]benzoate Openeye Name: ethyl 4-[2-[2-(3-pyridyl)indol-1-yl]ethylsulfanyl]benzoate CAS Name: 4-[2-[2-(3-pyridinyl)-1-indolyl]ethylthio]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-pyridin-3-ylindol-1-yl)ethylsulfanyl]benzoate Traditional Name: 4-[2-[2-(3-pyridyl)indol-1-yl]ethylthio]benzoic acid ethyl ester Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)SCCN2C3=CC=CC=C3C=C2C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)SCCN2C3=CC=CC=C3C=C2C4=CN=CC=C4

InChI

InChI=1S/C24H22N2O2S/c1-2-28-24(27)18-9-11-21(12-10-18)29-15-14-26-22-8-4-3-6-19(22)16-23(26)20-7-5-13-25-17-20/h3-13,16-17H,2,14-15H2,1H3