(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[2-(4-ethoxyphenyl)-1-pyrrolidinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-(2-p-phenetylpyrrolidino)methanone Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2C(=O)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C18H20ClN3O2S/c1-3-24-13-8-6-12(7-9-13)15-5-4-10-22(15)17(23)16-14(19)11-20-18(21-16)25-2/h6-9,11,15H,3-5,10H2,1-2H3