4-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: 4-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 4-[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 4-[[[4-(diethylamino)-5,6-dimethyl-2-pyrimidinyl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 4-[[4-(diethylamino)-5,6-dimethylpyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 4-[[[4-(diethylamino)-5,6-dimethyl-pyrimidin-2-yl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide Formula: C22H33N5OS MolecularWeight: 415.59532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1C)C)SCC2=CC=C(C=C2)C(=O)NCCN(C)C

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1C)C)SCC2=CC=C(C=C2)C(=O)NCCN(C)C

InChI

InChI=1S/C22H33N5OS/c1-7-27(8-2)20-16(3)17(4)24-22(25-20)29-15-18-9-11-19(12-10-18)21(28)23-13-14-26(5)6/h9-12H,7-8,13-15H2,1-6H3,(H,23,28)