2-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4,4-dimethyl-3H-pyridine-3,5-dicarbonitrile Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=NC(=C1C#N)SCC(=O)C2=CC=C(C=C2)OC)N)C#N)C

Isomeric SMILES

CC1(C(C(=NC(=C1C#N)SCC(=O)C2=CC=C(C=C2)OC)N)C#N)C

InChI

InChI=1S/C18H18N4O2S/c1-18(2)13(8-19)16(21)22-17(14(18)9-20)25-10-15(23)11-4-6-12(24-3)7-5-11/h4-7,13H,10H2,1-3H3,(H2,21,22)