4-[[4-[4-(1-methylpiperidin-4-yl)sulfonylphenyl]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[4-[4-(1-methylpiperidin-4-yl)sulfonylphenyl]pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[4-[4-[(1-methyl-4-piperidyl)sulfonyl]phenyl]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[4-[4-[(1-methyl-4-piperidinyl)sulfonyl]phenyl]-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[4-[4-(1-methylpiperidin-4-yl)sulfonylphenyl]pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[4-[4-[(1-methyl-4-piperidyl)sulfonyl]phenyl]pyrimidin-2-yl]amino]benzamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CN1CCC(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C23H25N5O3S/c1-28-14-11-20(12-15-28)32(30,31)19-8-4-16(5-9-19)21-10-13-25-23(27-21)26-18-6-2-17(3-7-18)22(24)29/h2-10,13,20H,11-12,14-15H2,1H3,(H2,24,29)(H,25,26,27)