3-[[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: 3-[[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 3-[[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 3-[[[4-(diethylamino)-6-(methoxymethyl)-2-pyrimidinyl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 3-[[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 3-[[[4-(diethylamino)-6-(methoxymethyl)pyrimidin-2-yl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide Formula: C22H33N5O2S MolecularWeight: 431.59472

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)COC)SCC2=CC=CC(=C2)C(=O)NCCN(C)C

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)COC)SCC2=CC=CC(=C2)C(=O)NCCN(C)C

InChI

InChI=1S/C22H33N5O2S/c1-6-27(7-2)20-14-19(15-29-5)24-22(25-20)30-16-17-9-8-10-18(13-17)21(28)23-11-12-26(3)4/h8-10,13-14H,6-7,11-12,15-16H2,1-5H3,(H,23,28)