6-azanyl-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-azanyl-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-amino-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-amino-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 6-amino-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-amino-2-tert-butyl-5-[ethoxy(phenyl)phosphoryl]-4-(methylthio)nicotinonitrile Formula: C19H24N3O2PS MolecularWeight: 389.451521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=CC=C1)C2=C(N=C(C(=C2SC)C#N)C(C)(C)C)N

Isomeric SMILES

CCOP(=O)(C1=CC=CC=C1)C2=C(N=C(C(=C2SC)C#N)C(C)(C)C)N

InChI

InChI=1S/C19H24N3O2PS/c1-6-24-25(23,13-10-8-7-9-11-13)15-16(26-5)14(12-20)17(19(2,3)4)22-18(15)21/h7-11H,6H2,1-5H3,(H2,21,22)