4-[(6-chloranylpyrimidin-4-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[(6-chloranylpyrimidin-4-yl)amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[(6-chloropyrimidin-4-yl)amino]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[(6-chloro-4-pyrimidinyl)amino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[(6-chloropyrimidin-4-yl)amino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[(6-chloropyrimidin-4-yl)amino]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C16H15ClN4O2 MolecularWeight: 330.7689

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CC(=NC=N3)Cl)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CC(=NC=N3)Cl)O)C

InChI

InChI=1S/C16H15ClN4O2/c1-16(2)15(22)14(21-13-6-12(17)19-8-20-13)10-5-9(7-18)3-4-11(10)23-16/h3-6,8,14-15,22H,1-2H3,(H,19,20,21)