[1-[4-(3-methoxyphenyl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: [1-[4-(3-methoxyphenyl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: [1-[4-(3-methoxyphenyl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: [1-[4-(3-methoxyphenyl)-2-pyrimidinyl]-5-methyl-4-pyrazolyl]-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: [1-[4-(3-methoxyphenyl)pyrimidin-2-yl]-5-methylpyrazol-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: [1-[4-(3-methoxyphenyl)pyrimidin-2-yl]-5-methyl-pyrazol-4-yl]-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C22H26N6O2 MolecularWeight: 406.48084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC(=CC=C3)OC)C(=O)N4CCCN(CC4)C

Isomeric SMILES

CC1=C(C=NN1C2=NC=CC(=N2)C3=CC(=CC=C3)OC)C(=O)N4CCCN(CC4)C

InChI

InChI=1S/C22H26N6O2/c1-16-19(21(29)27-11-5-10-26(2)12-13-27)15-24-28(16)22-23-9-8-20(25-22)17-6-4-7-18(14-17)30-3/h4,6-9,14-15H,5,10-13H2,1-3H3