3-hexyl-4,5-dimethyl-7-methylsulfonyl-4-oxidanyl-pyrido[4,3-d]pyrimidine-8-carbonitrile

Systemtic Name: 3-hexyl-4,5-dimethyl-7-methylsulfonyl-4-oxidanyl-pyrido[4,3-d]pyrimidine-8-carbonitrile Openeye Name: 3-hexyl-4-hydroxy-4,5-dimethyl-7-methylsulfonyl-pyrido[4,3-d]pyrimidine-8-carbonitrile CAS Name: 3-hexyl-4-hydroxy-4,5-dimethyl-7-methylsulfonyl-8-pyrido[4,3-d]pyrimidinecarbonitrile IUPAC Name: 3-hexyl-4-hydroxy-4,5-dimethyl-7-methylsulfonylpyrido[4,3-d]pyrimidine-8-carbonitrile Traditional Name: 3-hexyl-4-hydroxy-7-mesyl-4,5-dimethyl-pyrido[4,3-d]pyrimidine-8-carbonitrile Formula: C17H24N4O3S MolecularWeight: 364.46246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C(C(=NC(=C2C1(C)O)C)S(=O)(=O)C)C#N

Isomeric SMILES

CCCCCCN1C=NC2=C(C(=NC(=C2C1(C)O)C)S(=O)(=O)C)C#N

InChI

InChI=1S/C17H24N4O3S/c1-5-6-7-8-9-21-11-19-15-13(10-18)16(25(4,23)24)20-12(2)14(15)17(21,3)22/h11,22H,5-9H2,1-4H3