N-(4-tert-butylphenyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-6-(3-methyl-1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-6-(3-methylpiperazin-1-yl)pyridine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-6-(3-methylpiperazino)nicotinamide Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H28N4O/c1-15-14-25(12-11-22-15)19-10-5-16(13-23-19)20(26)24-18-8-6-17(7-9-18)21(2,3)4/h5-10,13,15,22H,11-12,14H2,1-4H3,(H,24,26)