N-(1,3-benzodioxol-5-ylmethyl)-2-[1-ethanoyl-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-2-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[1-ethanoyl-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-2-yl]ethanamide Openeye Name: 2-[1-acetyl-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide CAS Name: 2-[1-acetyl-4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperazinyl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide IUPAC Name: 2-[1-acetyl-4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperazin-2-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide Traditional Name: 2-[1-acetyl-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperazin-2-yl]-N-piperonyl-acetamide Formula: C24H27N7O4 MolecularWeight: 477.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)CC(=O)NCC4=CC5=C(C=C4)OCO5)C(=O)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)CC(=O)NCC4=CC5=C(C=C4)OCO5)C(=O)C

InChI

InChI=1S/C24H27N7O4/c1-16-9-22(28-24(27-16)30-6-5-25-14-30)29-7-8-31(17(2)32)19(13-29)11-23(33)26-12-18-3-4-20-21(10-18)35-15-34-20/h3-6,9-10,14,19H,7-8,11-13,15H2,1-2H3,(H,26,33)