2-[2-(1-ethylindol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(1-ethylindol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(1-ethylindol-3-yl)-2-oxo-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(1-ethyl-3-indolyl)-2-oxoethyl]thio]-4-(methoxymethyl)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(1-ethylindol-3-yl)-2-oxoethyl]sulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile Traditional Name: 2-[[2-(1-ethylindol-3-yl)-2-keto-ethyl]thio]-4-(methoxymethyl)-6-methyl-nicotinonitrile Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C(=O)CSC3=C(C(=CC(=N3)C)COC)C#N

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C(=O)CSC3=C(C(=CC(=N3)C)COC)C#N

InChI

InChI=1S/C21H21N3O2S/c1-4-24-11-18(16-7-5-6-8-19(16)24)20(25)13-27-21-17(10-22)15(12-26-3)9-14(2)23-21/h5-9,11H,4,12-13H2,1-3H3