N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)-1-(2-methoxyethanoyl)piperazine-2-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)-1-(2-methoxyethanoyl)piperazine-2-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]-1-(2-methoxy-1-oxoethyl)-2-piperazinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-1-(2-methoxyacetyl)piperazine-2-carboxamide Formula: C27H33N7O5 MolecularWeight: 535.59482

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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)COC

Isomeric SMILES

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

InChI

InChI=1S/C27H33N7O5/c1-18(2)20-13-24(31-27(30-20)33-7-6-28-17-33)32-8-9-34(25(35)16-37-3)21(15-32)26(36)29-14-19-4-5-22-23(12-19)39-11-10-38-22/h4-7,12-13,17-18,21H,8-11,14-16H2,1-3H3,(H,29,36)