2-[[3-chloranyl-2-(4-hydroxyphenyl)-4-oxidanylidene-azetidin-1-yl]amino]-4-(4-chlorophenyl)-1-methyl-6-oxidanylidene-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[3-chloranyl-2-(4-hydroxyphenyl)-4-oxidanylidene-azetidin-1-yl]amino]-4-(4-chlorophenyl)-1-methyl-6-oxidanylidene-pyrimidine-5-carbonitrile Openeye Name: 2-[[3-chloro-2-(4-hydroxyphenyl)-4-oxo-azetidin-1-yl]amino]-4-(4-chlorophenyl)-1-methyl-6-oxo-pyrimidine-5-carbonitrile CAS Name: 2-[[3-chloro-2-(4-hydroxyphenyl)-4-oxo-1-azetidinyl]amino]-4-(4-chlorophenyl)-1-methyl-6-oxo-5-pyrimidinecarbonitrile IUPAC Name: 2-[[3-chloro-2-(4-hydroxyphenyl)-4-oxoazetidin-1-yl]amino]-4-(4-chlorophenyl)-1-methyl-6-oxopyrimidine-5-carbonitrile Traditional Name: 2-[[3-chloro-2-(4-hydroxyphenyl)-4-keto-azetidin-1-yl]amino]-4-(4-chlorophenyl)-6-keto-1-methyl-pyrimidine-5-carbonitrile Formula: C21H15Cl2N5O3 MolecularWeight: 456.2815

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1NN2C(C(C2=O)Cl)C3=CC=C(C=C3)O)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CN1C(=O)C(=C(N=C1NN2C(C(C2=O)Cl)C3=CC=C(C=C3)O)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C21H15Cl2N5O3/c1-27-19(30)15(10-24)17(11-2-6-13(22)7-3-11)25-21(27)26-28-18(16(23)20(28)31)12-4-8-14(29)9-5-12/h2-9,16,18,29H,1H3,(H,25,26)