2-chloranyl-6-[4-[[[3-(3-cyanopropanoylamino)-4-methyl-pyridin-2-yl]amino]methyl]phenyl]benzamide

Systemtic Name: 2-chloranyl-6-[4-[[[3-(3-cyanopropanoylamino)-4-methyl-pyridin-2-yl]amino]methyl]phenyl]benzamide Openeye Name: 2-chloro-6-[4-[[[3-(3-cyanopropanoylamino)-4-methyl-2-pyridyl]amino]methyl]phenyl]benzamide CAS Name: 2-chloro-6-[4-[[[3-[(3-cyano-1-oxopropyl)amino]-4-methyl-2-pyridinyl]amino]methyl]phenyl]benzamide IUPAC Name: 2-chloro-6-[4-[[[3-(3-cyanopropanoylamino)-4-methylpyridin-2-yl]amino]methyl]phenyl]benzamide Traditional Name: 2-chloro-6-[4-[[[3-(3-cyanopropanoylamino)-4-methyl-2-pyridyl]amino]methyl]phenyl]benzamide Formula: C24H22ClN5O2 MolecularWeight: 447.91678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)NCC2=CC=C(C=C2)C3=C(C(=CC=C3)Cl)C(=O)N)NC(=O)CCC#N

Isomeric SMILES

CC1=C(C(=NC=C1)NCC2=CC=C(C=C2)C3=C(C(=CC=C3)Cl)C(=O)N)NC(=O)CCC#N

InChI

InChI=1S/C24H22ClN5O2/c1-15-11-13-28-24(22(15)30-20(31)6-3-12-26)29-14-16-7-9-17(10-8-16)18-4-2-5-19(25)21(18)23(27)32/h2,4-5,7-11,13H,3,6,14H2,1H3,(H2,27,32)(H,28,29)(H,30,31)