N-(2-aminophenyl)-4-[3-cyano-5-[(prop-2-enylamino)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-cyano-5-[(prop-2-enylamino)methyl]pyridin-2-yl]benzamide Openeye Name: 4-[5-[(allylamino)methyl]-3-cyano-2-pyridyl]-N-(2-aminophenyl)benzamide CAS Name: N-(2-aminophenyl)-4-[3-cyano-5-[(prop-2-enylamino)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-cyano-5-[(prop-2-enylamino)methyl]pyridin-2-yl]benzamide Traditional Name: 4-[5-[(allylamino)methyl]-3-cyano-2-pyridyl]-N-(2-aminophenyl)benzamide Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNCC1=CN=C(C(=C1)C#N)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

C=CCNCC1=CN=C(C(=C1)C#N)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C23H21N5O/c1-2-11-26-14-16-12-19(13-24)22(27-15-16)17-7-9-18(10-8-17)23(29)28-21-6-4-3-5-20(21)25/h2-10,12,15,26H,1,11,14,25H2,(H,28,29)