N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]cyclopentanecarboxamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]cyclopentanecarboxamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]cyclopentanecarboxamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]cyclopentanecarboxamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]cyclopentanecarboxamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]cyclopentanecarboxamide Formula: C18H21N3OS MolecularWeight: 327.44384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)C3CCCC3)C

InChI

InChI=1S/C18H21N3OS/c1-12-11-13(2)20-18(19-12)23-16-9-7-15(8-10-16)21-17(22)14-5-3-4-6-14/h7-11,14H,3-6H2,1-2H3,(H,21,22)