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

Systemtic Name: N-cyclopropyl-4-[(4-phenyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-4-[(4-phenyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-4-[[[4-phenyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[(4-phenyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-4-[[(4-phenyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(C=C4)C(=O)NC5CC5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(C=C4)C(=O)NC5CC5

InChI

InChI=1S/C25H26N4OS/c30-24(26-21-12-13-21)20-10-8-18(9-11-20)17-31-25-27-22(19-6-2-1-3-7-19)16-23(28-25)29-14-4-5-15-29/h1-3,6-11,16,21H,4-5,12-15,17H2,(H,26,30)