N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C18H21ClN4OS MolecularWeight: 376.90354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)C

InChI

InChI=1S/C18H21ClN4OS/c1-12-10-13(2)21-18(20-12)25-11-16(24)22-15-7-5-6-14(19)17(15)23-8-3-4-9-23/h5-7,10H,3-4,8-9,11H2,1-2H3,(H,22,24)