1-(4H-1,3-benzodioxin-6-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)piperazine-2-carboxamide

Systemtic Name: 1-(4H-1,3-benzodioxin-6-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)piperazine-2-carboxamide Openeye Name: 1-(4H-1,3-benzodioxin-6-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)piperazine-2-carboxamide CAS Name: 1-(4H-1,3-benzodioxin-6-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperazinecarboxamide IUPAC Name: 1-(4H-1,3-benzodioxin-6-ylmethyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)piperazine-2-carboxamide Traditional Name: 1-(4H-1,3-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-ylpyrimidin-4-yl)-N-piperonyl-piperazine-2-carboxamide Formula: C29H29N7O5 MolecularWeight: 555.58446

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C2=NC(=NC=C2)N3C=CN=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)CC6=CC7=C(C=C6)OCOC7

Isomeric SMILES

C1CN(C(CN1C2=NC(=NC=C2)N3C=CN=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)CC6=CC7=C(C=C6)OCOC7

InChI

InChI=1S/C29H29N7O5/c37-28(32-13-20-1-4-25-26(12-20)41-19-40-25)23-15-35(27-5-6-31-29(33-27)36-8-7-30-17-36)10-9-34(23)14-21-2-3-24-22(11-21)16-38-18-39-24/h1-8,11-12,17,23H,9-10,13-16,18-19H2,(H,32,37)