N-ethyl-N-methyl-3-[(4-phenyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide

Systemtic Name: N-ethyl-N-methyl-3-[(4-phenyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-ethyl-N-methyl-3-[(4-phenyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-ethyl-N-methyl-3-[[[4-phenyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-ethyl-N-methyl-3-[(4-phenyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-ethyl-N-methyl-3-[[(4-phenyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CCN(C)C(=O)C1=CC(=CC=C1)CSC2=NC(=CC(=N2)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4OS/c1-3-28(2)24(30)21-13-9-10-19(16-21)18-31-25-26-22(20-11-5-4-6-12-20)17-23(27-25)29-14-7-8-15-29/h4-6,9-13,16-17H,3,7-8,14-15,18H2,1-2H3