3-[[4-(diethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide

Systemtic Name: 3-[[4-(diethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Openeye Name: 3-[[4-(diethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-isobutyl-benzamide CAS Name: 3-[[[4-(diethylamino)-6-methyl-2-pyrimidinyl]thio]methyl]-N-(2-methylpropyl)benzamide IUPAC Name: 3-[[4-(diethylamino)-6-methylpyrimidin-2-yl]sulfanylmethyl]-N-(2-methylpropyl)benzamide Traditional Name: 3-[[[4-(diethylamino)-6-methyl-pyrimidin-2-yl]thio]methyl]-N-isobutyl-benzamide Formula: C21H30N4OS MolecularWeight: 386.5541

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)C)SCC2=CC=CC(=C2)C(=O)NCC(C)C

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)C)SCC2=CC=CC(=C2)C(=O)NCC(C)C

InChI

InChI=1S/C21H30N4OS/c1-6-25(7-2)19-11-16(5)23-21(24-19)27-14-17-9-8-10-18(12-17)20(26)22-13-15(3)4/h8-12,15H,6-7,13-14H2,1-5H3,(H,22,26)