7-chloranyl-5-(2-methoxyethyl)-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-chloranyl-5-(2-methoxyethyl)-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(benzenesulfonyl)-7-chloro-5-(2-methoxyethyl)-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(benzenesulfonyl)-7-chloro-5-(2-methoxyethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(benzenesulfonyl)-7-chloro-5-(2-methoxyethyl)-2-methylsulfanylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-besyl-7-chloro-5-(2-methoxyethyl)-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C16H16ClN3O3S2 MolecularWeight: 397.89954

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=NC2=C(C(=NN2C(=C1)Cl)SC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COCCC1=NC2=C(C(=NN2C(=C1)Cl)SC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H16ClN3O3S2/c1-23-9-8-11-10-13(17)20-15(18-11)14(16(19-20)24-2)25(21,22)12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3