3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide

Systemtic Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide Openeye Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-ethyl-benzamide CAS Name: 3-[[[4-tert-butyl-6-(diethylamino)-2-pyrimidinyl]thio]methyl]-N-ethylbenzamide IUPAC Name: 3-[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]sulfanylmethyl]-N-ethylbenzamide Traditional Name: 3-[[[4-tert-butyl-6-(diethylamino)pyrimidin-2-yl]thio]methyl]-N-ethyl-benzamide Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N(CC)CC)C(C)(C)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N(CC)CC)C(C)(C)C

InChI

InChI=1S/C22H32N4OS/c1-7-23-20(27)17-12-10-11-16(13-17)15-28-21-24-18(22(4,5)6)14-19(25-21)26(8-2)9-3/h10-14H,7-9,15H2,1-6H3,(H,23,27)