2-[2-(5-bromanyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2-(5-bromanyl-2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile Openeye Name: 2-[2-(5-bromoindolin-1-yl)-2-oxo-ethyl]sulfanyl-4-(methoxymethyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 2-[[2-(5-bromo-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-4-(methoxymethyl)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-(5-bromo-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile Traditional Name: 2-[[2-(5-bromoindolin-1-yl)-2-keto-ethyl]thio]-4-(methoxymethyl)-6-methyl-nicotinonitrile Formula: C19H18BrN3O2S MolecularWeight: 432.33412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)COC)C#N)SCC(=O)N2CCC3=C2C=CC(=C3)Br

Isomeric SMILES

CC1=NC(=C(C(=C1)COC)C#N)SCC(=O)N2CCC3=C2C=CC(=C3)Br

InChI

InChI=1S/C19H18BrN3O2S/c1-12-7-14(10-25-2)16(9-21)19(22-12)26-11-18(24)23-6-5-13-8-15(20)3-4-17(13)23/h3-4,7-8H,5-6,10-11H2,1-2H3