4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: 4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-(thiophen-2-ylmethyl)benzamide Openeye Name: 4-methyl-3-[(3-pyrimidin-4-yl-2-pyridyl)amino]-N-(2-thienylmethyl)benzamide CAS Name: 4-methyl-3-[[3-(4-pyrimidinyl)-2-pyridinyl]amino]-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: 4-methyl-3-[(3-pyrimidin-4-ylpyridin-2-yl)amino]-N-(thiophen-2-ylmethyl)benzamide Traditional Name: 4-methyl-3-[[3-(4-pyrimidyl)-2-pyridyl]amino]-N-(2-thenyl)benzamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CS2)NC3=C(C=CC=N3)C4=NC=NC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=CS2)NC3=C(C=CC=N3)C4=NC=NC=C4

InChI

InChI=1S/C22H19N5OS/c1-15-6-7-16(22(28)25-13-17-4-3-11-29-17)12-20(15)27-21-18(5-2-9-24-21)19-8-10-23-14-26-19/h2-12,14H,13H2,1H3,(H,24,27)(H,25,28)