3-acetamido-4-methyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 3-acetamido-4-methyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 3-acetamido-4-methyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]benzamide CAS Name: 3-acetamido-4-methyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]benzamide IUPAC Name: 3-acetamido-4-methyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]benzamide Traditional Name: 3-acetamido-N-[6-(3-ketopiperazino)-3-pyridyl]-4-methyl-benzamide Formula: C19H21N5O3 MolecularWeight: 367.40174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3)NC(=O)C

InChI

InChI=1S/C19H21N5O3/c1-12-3-4-14(9-16(12)22-13(2)25)19(27)23-15-5-6-17(21-10-15)24-8-7-20-18(26)11-24/h3-6,9-10H,7-8,11H2,1-2H3,(H,20,26)(H,22,25)(H,23,27)