(4R)-2-azanyl-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: (4R)-2-azanyl-4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: (4R)-2-amino-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: (4R)-2-amino-4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: (4R)-2-amino-4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: (4R)-2-amino-4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C20H17ClN4O2 MolecularWeight: 380.82758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C(=C(OC3=C2C(=O)CCC3)N)C#N)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1[C@@H]2C(=C(OC3=C2C(=O)CCC3)N)C#N)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H17ClN4O2/c1-11-16(19(21)25(24-11)12-6-3-2-4-7-12)17-13(10-22)20(23)27-15-9-5-8-14(26)18(15)17/h2-4,6-7,17H,5,8-9,23H2,1H3/t17-/m0/s1