3-[[4-[methyl(propyl)amino]-6-propan-2-yl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide

Systemtic Name: 3-[[4-[methyl(propyl)amino]-6-propan-2-yl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Openeye Name: 3-[[4-isopropyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N-[2-(2-pyridyl)ethyl]benzamide CAS Name: 3-[[[4-[methyl(propyl)amino]-6-propan-2-yl-2-pyrimidinyl]thio]methyl]-N-[2-(2-pyridinyl)ethyl]benzamide IUPAC Name: 3-[[4-[methyl(propyl)amino]-6-propan-2-ylpyrimidin-2-yl]sulfanylmethyl]-N-(2-pyridin-2-ylethyl)benzamide Traditional Name: 3-[[[4-isopropyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]-N-[2-(2-pyridyl)ethyl]benzamide Formula: C26H33N5OS MolecularWeight: 463.63812

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)C(C)C)SCC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)C(C)C)SCC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C26H33N5OS/c1-5-15-31(4)24-17-23(19(2)3)29-26(30-24)33-18-20-9-8-10-21(16-20)25(32)28-14-12-22-11-6-7-13-27-22/h6-11,13,16-17,19H,5,12,14-15,18H2,1-4H3,(H,28,32)