3-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 3-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide Openeye Name: 3-[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-furylmethyl)benzamide CAS Name: 3-[[[4-(dimethylamino)-6-methyl-2-pyrimidinyl]thio]methyl]-N-(2-furanylmethyl)benzamide IUPAC Name: 3-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]sulfanylmethyl]-N-(furan-2-ylmethyl)benzamide Traditional Name: 3-[[[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]thio]methyl]-N-(2-furfuryl)benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NCC3=CC=CO3)N(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC(=C2)C(=O)NCC3=CC=CO3)N(C)C

InChI

InChI=1S/C20H22N4O2S/c1-14-10-18(24(2)3)23-20(22-14)27-13-15-6-4-7-16(11-15)19(25)21-12-17-8-5-9-26-17/h4-11H,12-13H2,1-3H3,(H,21,25)