N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(2-methoxyphenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-methyl-2-(o-anisylamino)pyrimidine-5-carboxamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCO3)NCC4=CC=CC=C4OC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC3=C(C=C2)OCO3)NCC4=CC=CC=C4OC

InChI

InChI=1S/C21H20N4O4/c1-13-16(20(26)25-15-7-8-18-19(9-15)29-12-28-18)11-23-21(24-13)22-10-14-5-3-4-6-17(14)27-2/h3-9,11H,10,12H2,1-2H3,(H,25,26)(H,22,23,24)