N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-(5-methyl-4-thiophen-2-yl-pyrimidin-2-yl)pyrazole-4-carboxamide

Systemtic Name: N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-(5-methyl-4-thiophen-2-yl-pyrimidin-2-yl)pyrazole-4-carboxamide Openeye Name: N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-[5-methyl-4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide CAS Name: N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-(5-methyl-4-thiophen-2-yl-2-pyrimidinyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-(5-methyl-4-thiophen-2-ylpyrimidin-2-yl)pyrazole-4-carboxamide Traditional Name: N-(1,4-dioxan-2-ylmethyl)-5-methyl-1-[5-methyl-4-(2-thienyl)pyrimidin-2-yl]pyrazole-4-carboxamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC=CS2)N3C(=C(C=N3)C(=O)NCC4COCCO4)C

Isomeric SMILES

CC1=CN=C(N=C1C2=CC=CS2)N3C(=C(C=N3)C(=O)NCC4COCCO4)C

InChI

InChI=1S/C19H21N5O3S/c1-12-8-21-19(23-17(12)16-4-3-7-28-16)24-13(2)15(10-22-24)18(25)20-9-14-11-26-5-6-27-14/h3-4,7-8,10,14H,5-6,9,11H2,1-2H3,(H,20,25)