1-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]-3-(4-methoxyphenyl)urea Openeye Name: 1-[[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]methyl]-3-(4-methoxyphenyl)urea CAS Name: 1-[[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidinyl]methyl]-3-(4-methoxyphenyl)urea IUPAC Name: 1-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]-3-(4-methoxyphenyl)urea Traditional Name: 1-[[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]methyl]-3-(4-methoxyphenyl)urea Formula: C21H25N7O2 MolecularWeight: 407.4689

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCC2CCCCN2C3=NC(=NC=C3)N4C=CN=C4

InChI

InChI=1S/C21H25N7O2/c1-30-18-7-5-16(6-8-18)25-21(29)24-14-17-4-2-3-12-28(17)19-9-10-23-20(26-19)27-13-11-22-15-27/h5-11,13,15,17H,2-4,12,14H2,1H3,(H2,24,25,29)