4,5,6-trimethyl-2-methylsulfanyl-3-naphthalen-2-ylsulfonyl-7H-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 4,5,6-trimethyl-2-methylsulfanyl-3-naphthalen-2-ylsulfonyl-7H-pyrazolo[1,5-a]pyrimidine Openeye Name: 4,5,6-trimethyl-2-methylsulfanyl-3-(2-naphthylsulfonyl)-7H-pyrazolo[1,5-a]pyrimidine CAS Name: 4,5,6-trimethyl-2-(methylthio)-3-(2-naphthalenylsulfonyl)-7H-pyrazolo[1,5-a]pyrimidine IUPAC Name: 4,5,6-trimethyl-2-methylsulfanyl-3-naphthalen-2-ylsulfonyl-7H-pyrazolo[1,5-a]pyrimidine Traditional Name: 4,5,6-trimethyl-2-(methylthio)-3-(2-naphthylsulfonyl)-7H-pyrazolo[1,5-a]pyrimidine Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C(C(=NN2C1)SC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C)C

Isomeric SMILES

CC1=C(N(C2=C(C(=NN2C1)SC)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C)C

InChI

InChI=1S/C20H21N3O2S2/c1-13-12-23-20(22(3)14(13)2)18(19(21-23)26-4)27(24,25)17-10-9-15-7-5-6-8-16(15)11-17/h5-11H,12H2,1-4H3