2-(1,3-benzodioxol-5-yl)-N-(1-methylpiperidin-4-yl)-4-phenylazanyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(1-methylpiperidin-4-yl)-4-phenylazanyl-pyrimidine-5-carboxamide Openeye Name: 4-anilino-2-(1,3-benzodioxol-5-yl)-N-(1-methyl-4-piperidyl)pyrimidine-5-carboxamide CAS Name: 4-anilino-2-(1,3-benzodioxol-5-yl)-N-(1-methyl-4-piperidinyl)-5-pyrimidinecarboxamide IUPAC Name: 4-anilino-2-(1,3-benzodioxol-5-yl)-N-(1-methylpiperidin-4-yl)pyrimidine-5-carboxamide Traditional Name: 4-anilino-2-(1,3-benzodioxol-5-yl)-N-(1-methyl-4-piperidyl)pyrimidine-5-carboxamide Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC(=O)C2=CN=C(N=C2NC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCC(CC1)NC(=O)C2=CN=C(N=C2NC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H25N5O3/c1-29-11-9-18(10-12-29)27-24(30)19-14-25-22(16-7-8-20-21(13-16)32-15-31-20)28-23(19)26-17-5-3-2-4-6-17/h2-8,13-14,18H,9-12,15H2,1H3,(H,27,30)(H,25,26,28)