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

Systemtic Name: 4-[[4-(diethylamino)-6-propan-2-yl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 4-[[4-(diethylamino)-6-isopropyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 4-[[[4-(diethylamino)-6-propan-2-yl-2-pyrimidinyl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 4-[[4-(diethylamino)-6-propan-2-ylpyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 4-[[[4-(diethylamino)-6-isopropyl-pyrimidin-2-yl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide Formula: C23H35N5OS MolecularWeight: 429.6219

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N5OS/c1-7-28(8-2)21-15-20(17(3)4)25-23(26-21)30-16-18-9-11-19(12-10-18)22(29)24-13-14-27(5)6/h9-12,15,17H,7-8,13-14,16H2,1-6H3,(H,24,29)