2-methyl-N-[2-[(1-methylpiperidin-4-yl)amino]pyrimidin-5-yl]-5-nitro-benzamide

Systemtic Name: 2-methyl-N-[2-[(1-methylpiperidin-4-yl)amino]pyrimidin-5-yl]-5-nitro-benzamide Openeye Name: 2-methyl-N-[2-[(1-methyl-4-piperidyl)amino]pyrimidin-5-yl]-5-nitro-benzamide CAS Name: 2-methyl-N-[2-[(1-methyl-4-piperidinyl)amino]-5-pyrimidinyl]-5-nitrobenzamide IUPAC Name: 2-methyl-N-[2-[(1-methylpiperidin-4-yl)amino]pyrimidin-5-yl]-5-nitrobenzamide Traditional Name: 2-methyl-N-[2-[(1-methyl-4-piperidyl)amino]pyrimidin-5-yl]-5-nitro-benzamide Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CN=C(N=C2)NC3CCN(CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CN=C(N=C2)NC3CCN(CC3)C

InChI

InChI=1S/C18H22N6O3/c1-12-3-4-15(24(26)27)9-16(12)17(25)21-14-10-19-18(20-11-14)22-13-5-7-23(2)8-6-13/h3-4,9-11,13H,5-8H2,1-2H3,(H,21,25)(H,19,20,22)