[4-(3,5-dimethylphenyl)piperazin-1-yl]-[6-(propan-2-ylamino)pyridin-3-yl]methanone

Systemtic Name: [4-(3,5-dimethylphenyl)piperazin-1-yl]-[6-(propan-2-ylamino)pyridin-3-yl]methanone Openeye Name: [4-(3,5-dimethylphenyl)piperazin-1-yl]-[6-(isopropylamino)-3-pyridyl]methanone CAS Name: [4-(3,5-dimethylphenyl)-1-piperazinyl]-[6-(propan-2-ylamino)-3-pyridinyl]methanone IUPAC Name: [4-(3,5-dimethylphenyl)piperazin-1-yl]-[6-(propan-2-ylamino)pyridin-3-yl]methanone Traditional Name: [4-(3,5-dimethylphenyl)piperazino]-[6-(isopropylamino)-3-pyridyl]methanone Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)NC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)NC(C)C)C

InChI

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