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

Systemtic Name: N-ethyl-4-[(4-ethyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide Openeye Name: N-ethyl-4-[(4-ethyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]benzamide CAS Name: N-ethyl-4-[[[4-ethyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-ethyl-4-[(4-ethyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-ethyl-4-[[(4-ethyl-6-pyrrolidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC)N3CCCC3

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC)N3CCCC3

InChI

InChI=1S/C20H26N4OS/c1-3-17-13-18(24-11-5-6-12-24)23-20(22-17)26-14-15-7-9-16(10-8-15)19(25)21-4-2/h7-10,13H,3-6,11-12,14H2,1-2H3,(H,21,25)