5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-thiophen-2-ylsulfonyl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-thiophen-2-ylsulfonyl-pyrazolo[1,5-a]pyrimidine Openeye Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-(2-thienylsulfonyl)pyrazolo[1,5-a]pyrimidine CAS Name: 5-methyl-7-(4-methyl-1-piperazinyl)-2-(methylthio)-3-thiophen-2-ylsulfonylpyrazolo[1,5-a]pyrimidine IUPAC Name: 5-methyl-7-(4-methylpiperazin-1-yl)-2-methylsulfanyl-3-thiophen-2-ylsulfonylpyrazolo[1,5-a]pyrimidine Traditional Name: 5-methyl-7-(4-methylpiperazino)-2-(methylthio)-3-(2-thienylsulfonyl)pyrazolo[1,5-a]pyrimidine Formula: C17H21N5O2S3 MolecularWeight: 423.57594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)N3CCN(CC3)C)SC)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H21N5O2S3/c1-12-11-13(21-8-6-20(2)7-9-21)22-16(18-12)15(17(19-22)25-3)27(23,24)14-5-4-10-26-14/h4-5,10-11H,6-9H2,1-3H3