N-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]undec-10-enamide

Systemtic Name: N-[4-azanyl-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]undec-10-enamide Openeye Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]undec-10-enamide CAS Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrimidinyl]-10-undecenamide IUPAC Name: N-[4-amino-5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-2-yl]undec-10-enamide Traditional Name: N-[4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-yl]undec-10-enamide Formula: C25H36N4O4 MolecularWeight: 456.57774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)CCCCCCCCC=C

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)NC(=O)CCCCCCCCC=C

InChI

InChI=1S/C25H36N4O4/c1-5-6-7-8-9-10-11-12-13-22(30)28-25-27-17-19(24(26)29-25)14-18-15-20(31-2)23(33-4)21(16-18)32-3/h5,15-17H,1,6-14H2,2-4H3,(H3,26,27,28,29,30)