(2R)-N-(4-tert-butylphenyl)-4-(6-chloranyl-4-methyl-pyridazin-3-yl)-2-methyl-piperazine-1-carboxamide

Systemtic Name: (2R)-N-(4-tert-butylphenyl)-4-(6-chloranyl-4-methyl-pyridazin-3-yl)-2-methyl-piperazine-1-carboxamide Openeye Name: (2R)-N-(4-tert-butylphenyl)-4-(6-chloro-4-methyl-pyridazin-3-yl)-2-methyl-piperazine-1-carboxamide CAS Name: (2R)-N-(4-tert-butylphenyl)-4-(6-chloro-4-methyl-3-pyridazinyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: (2R)-N-(4-tert-butylphenyl)-4-(6-chloro-4-methylpyridazin-3-yl)-2-methylpiperazine-1-carboxamide Traditional Name: (2R)-N-(4-tert-butylphenyl)-4-(6-chloro-4-methyl-pyridazin-3-yl)-2-methyl-piperazine-1-carboxamide Formula: C21H28ClN5O MolecularWeight: 401.93292

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=NN=C(C=C3C)Cl

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=NN=C(C=C3C)Cl

InChI

InChI=1S/C21H28ClN5O/c1-14-12-18(22)24-25-19(14)26-10-11-27(15(2)13-26)20(28)23-17-8-6-16(7-9-17)21(3,4)5/h6-9,12,15H,10-11,13H2,1-5H3,(H,23,28)/t15-/m1/s1