N-(2-aminophenyl)-4-[3-methyl-5-[(4-propan-2-ylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[3-methyl-5-[(4-propan-2-ylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide Openeye Name: N-(2-aminophenyl)-4-[5-[(4-isopropylpiperazin-1-yl)methyl]-3-methyl-2-pyridyl]benzamide CAS Name: N-(2-aminophenyl)-4-[3-methyl-5-[(4-propan-2-yl-1-piperazinyl)methyl]-2-pyridinyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[3-methyl-5-[(4-propan-2-ylpiperazin-1-yl)methyl]pyridin-2-yl]benzamide Traditional Name: N-(2-aminophenyl)-4-[5-[(4-isopropylpiperazino)methyl]-3-methyl-2-pyridyl]benzamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)CN2CCN(CC2)C(C)C)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

CC1=C(N=CC(=C1)CN2CCN(CC2)C(C)C)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C27H33N5O/c1-19(2)32-14-12-31(13-15-32)18-21-16-20(3)26(29-17-21)22-8-10-23(11-9-22)27(33)30-25-7-5-4-6-24(25)28/h4-11,16-17,19H,12-15,18,28H2,1-3H3,(H,30,33)