N-(5-tert-butyl-2-methyl-pyrazol-3-yl)-4-(5-ethylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methyl-pyrazol-3-yl)-4-(5-ethylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide Openeye Name: N-(5-tert-butyl-2-methyl-pyrazol-3-yl)-4-(5-ethylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide CAS Name: N-(5-tert-butyl-2-methyl-3-pyrazolyl)-4-(5-ethyl-2-pyrimidinyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(5-tert-butyl-2-methylpyrazol-3-yl)-4-(5-ethylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide Traditional Name: N-(5-tert-butyl-2-methyl-pyrazol-3-yl)-4-(5-ethylpyrimidin-2-yl)-1,4-diazepane-1-carboxamide Formula: C20H31N7O MolecularWeight: 385.50644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N2CCCN(CC2)C(=O)NC3=CC(=NN3C)C(C)(C)C

Isomeric SMILES

CCC1=CN=C(N=C1)N2CCCN(CC2)C(=O)NC3=CC(=NN3C)C(C)(C)C

InChI

InChI=1S/C20H31N7O/c1-6-15-13-21-18(22-14-15)26-8-7-9-27(11-10-26)19(28)23-17-12-16(20(2,3)4)24-25(17)5/h12-14H,6-11H2,1-5H3,(H,23,28)