butanedioic acid; 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N,N-diethyl-ethanamine

Systemtic Name: butanedioic acid; 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N,N-diethyl-ethanamine Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N,N-diethyl-ethanamine; succinic acid CAS Name: butanedioic acid; 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N,N-diethylethanamine IUPAC Name: butanedioic acid; 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N,N-diethylethanamine Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]ethyl-diethyl-amine; succinic acid Formula: C16H27N3O4S MolecularWeight: 357.46828

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=CC(=N1)C)C.C(CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CC)CCSC1=NC(=CC(=N1)C)C.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H21N3S.C4H6O4/c1-5-15(6-2)7-8-16-12-13-10(3)9-11(4)14-12;5-3(6)1-2-4(7)8/h9H,5-8H2,1-4H3;1-2H2,(H,5,6)(H,7,8)