2-[(3-methoxyphenyl)methylamino]-4-methyl-N-(3-morpholin-4-ylpropyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[(3-methoxyphenyl)methylamino]-4-methyl-N-(3-morpholin-4-ylpropyl)pyrimidine-5-carboxamide Openeye Name: 2-[(3-methoxyphenyl)methylamino]-4-methyl-N-(3-morpholinopropyl)pyrimidine-5-carboxamide CAS Name: 2-[(3-methoxyphenyl)methylamino]-4-methyl-N-[3-(4-morpholinyl)propyl]-5-pyrimidinecarboxamide IUPAC Name: 2-[(3-methoxyphenyl)methylamino]-4-methyl-N-(3-morpholin-4-ylpropyl)pyrimidine-5-carboxamide Traditional Name: 2-(m-anisylamino)-4-methyl-N-(3-morpholinopropyl)pyrimidine-5-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCCCN2CCOCC2)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCCCN2CCOCC2)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H29N5O3/c1-16-19(20(27)22-7-4-8-26-9-11-29-12-10-26)15-24-21(25-16)23-14-17-5-3-6-18(13-17)28-2/h3,5-6,13,15H,4,7-12,14H2,1-2H3,(H,22,27)(H,23,24,25)