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

Systemtic Name: N-cyclopropyl-4-[(4-propan-2-yl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-cyclopropyl-4-[(4-isopropyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-cyclopropyl-4-[[[4-propan-2-yl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-cyclopropyl-4-[(4-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-cyclopropyl-4-[[(4-isopropyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NC3CC3)N4CCCC4

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NC3CC3)N4CCCC4

InChI

InChI=1S/C22H28N4OS/c1-15(2)19-13-20(26-11-3-4-12-26)25-22(24-19)28-14-16-5-7-17(8-6-16)21(27)23-18-9-10-18/h5-8,13,15,18H,3-4,9-12,14H2,1-2H3,(H,23,27)