3-[4-[(4-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]-5-methyl-4-(3-oxidanylazetidin-1-yl)pyrazole-4-carbaldehyde

Systemtic Name: 3-[4-[(4-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]-5-methyl-4-(3-oxidanylazetidin-1-yl)pyrazole-4-carbaldehyde Openeye Name: 4-(3-hydroxyazetidin-1-yl)-3-[4-[(4-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]-5-methyl-pyrazole-4-carbaldehyde CAS Name: 4-(3-hydroxy-1-azetidinyl)-3-[4-[(4-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]-5-methyl-4-pyrazolecarboxaldehyde IUPAC Name: 4-(3-hydroxyazetidin-1-yl)-3-[4-[(4-methoxyphenyl)methylamino]-1,3,5-triazin-2-yl]-5-methylpyrazole-4-carbaldehyde Traditional Name: 4-(3-hydroxyazetidin-1-yl)-3-methyl-5-[4-(p-anisylamino)-s-triazin-2-yl]pyrazole-4-carbaldehyde Formula: C19H21N7O3 MolecularWeight: 395.41514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C1(C=O)N2CC(C2)O)C3=NC(=NC=N3)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NN=C(C1(C=O)N2CC(C2)O)C3=NC(=NC=N3)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C19H21N7O3/c1-12-19(10-27,26-8-14(28)9-26)16(25-24-12)17-21-11-22-18(23-17)20-7-13-3-5-15(29-2)6-4-13/h3-6,10-11,14,28H,7-9H2,1-2H3,(H,20,21,22,23)