6-(3-methyl-4-propan-2-yl-piperazin-1-yl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-methyl-4-propan-2-yl-piperazin-1-yl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide Openeye Name: 6-(4-isopropyl-3-methyl-piperazin-1-yl)-N-[(3-propylisoxazol-5-yl)methyl]pyridine-3-carboxamide CAS Name: 6-(3-methyl-4-propan-2-yl-1-piperazinyl)-N-[(3-propyl-5-isoxazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-methyl-4-propan-2-ylpiperazin-1-yl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]pyridine-3-carboxamide Traditional Name: 6-(4-isopropyl-3-methyl-piperazino)-N-[(3-propylisoxazol-5-yl)methyl]nicotinamide Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=C1)CNC(=O)C2=CN=C(C=C2)N3CCN(C(C3)C)C(C)C

Isomeric SMILES

CCCC1=NOC(=C1)CNC(=O)C2=CN=C(C=C2)N3CCN(C(C3)C)C(C)C

InChI

InChI=1S/C21H31N5O2/c1-5-6-18-11-19(28-24-18)13-23-21(27)17-7-8-20(22-12-17)25-9-10-26(15(2)3)16(4)14-25/h7-8,11-12,15-16H,5-6,9-10,13-14H2,1-4H3,(H,23,27)