N-(2-hydroxyethyl)-6-[4-[3-(2-methylpropylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-pyridine-3-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-6-[4-[3-(2-methylpropylamino)pyridin-2-yl]piperazin-1-yl]carbonyl-pyridine-3-carboxamide Openeye Name: N-(2-hydroxyethyl)-6-[4-[3-(isobutylamino)-2-pyridyl]piperazine-1-carbonyl]pyridine-3-carboxamide CAS Name: N-(2-hydroxyethyl)-6-[[4-[3-(2-methylpropylamino)-2-pyridinyl]-1-piperazinyl]-oxomethyl]-3-pyridinecarboxamide IUPAC Name: N-(2-hydroxyethyl)-6-[4-[3-(2-methylpropylamino)pyridin-2-yl]piperazine-1-carbonyl]pyridine-3-carboxamide Traditional Name: N-(2-hydroxyethyl)-6-[4-[3-(isobutylamino)-2-pyridyl]piperazine-1-carbonyl]nicotinamide Formula: C22H30N6O3 MolecularWeight: 426.512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=NC=C(C=C3)C(=O)NCCO

Isomeric SMILES

CC(C)CNC1=C(N=CC=C1)N2CCN(CC2)C(=O)C3=NC=C(C=C3)C(=O)NCCO

InChI

InChI=1S/C22H30N6O3/c1-16(2)14-25-18-4-3-7-23-20(18)27-9-11-28(12-10-27)22(31)19-6-5-17(15-26-19)21(30)24-8-13-29/h3-7,15-16,25,29H,8-14H2,1-2H3,(H,24,30)