N1-cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperazine-1,2-dicarboxamide

Systemtic Name: N1-cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperazine-1,2-dicarboxamide Openeye Name: N1-cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazine-1,2-dicarboxamide CAS Name: N1-cyclohexyl-N2-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]piperazine-1,2-dicarboxamide IUPAC Name: 1-N-cyclohexyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)piperazine-1,2-dicarboxamide Traditional Name: N-cyclohexyl-N'-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)piperazine-1,2-dicarboxamide Formula: C31H40N8O4 MolecularWeight: 588.7005

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCC4=CC5=C(C=C4)OCCO5)C(=O)NC6CCCCC6

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCC4=CC5=C(C=C4)OCCO5)C(=O)NC6CCCCC6

InChI

InChI=1S/C31H40N8O4/c1-21(2)24-17-28(36-30(35-24)38-11-10-32-20-38)37-12-13-39(31(41)34-23-6-4-3-5-7-23)25(19-37)29(40)33-18-22-8-9-26-27(16-22)43-15-14-42-26/h8-11,16-17,20-21,23,25H,3-7,12-15,18-19H2,1-2H3,(H,33,40)(H,34,41)