2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-5,6-dimethoxy-4-piperidin-4-yl-3-propyl-benzamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-5,6-dimethoxy-4-piperidin-4-yl-3-propyl-benzamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-5,6-dimethoxy-4-(4-piperidyl)-3-propyl-benzamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-5,6-dimethoxy-4-(4-piperidinyl)-3-propylbenzamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-5,6-dimethoxy-4-piperidin-4-yl-3-propylbenzamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-5,6-dimethoxy-4-(4-piperidyl)-3-propyl-benzamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1C2CCNCC2)OC)OC)C(=O)N)SC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCCC1=C(C(=C(C(=C1C2CCNCC2)OC)OC)C(=O)N)SC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C23H32N4O3S/c1-6-7-16-17(15-8-10-25-11-9-15)19(29-4)20(30-5)18(22(24)28)21(16)31-23-26-13(2)12-14(3)27-23/h12,15,25H,6-11H2,1-5H3,(H2,24,28)