4-[4-(4-ethylpiperazin-1-yl)-4-oxidanylidene-butyl]-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one

Systemtic Name: 4-[4-(4-ethylpiperazin-1-yl)-4-oxidanylidene-butyl]-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one Openeye Name: 4-[4-(4-ethylpiperazin-1-yl)-4-oxo-butyl]-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one CAS Name: 4-[4-(4-ethyl-1-piperazinyl)-4-oxobutyl]-3-methyl-1-phenyl-5-pyrazolo[3,4-b][1,4]thiazinone IUPAC Name: 4-[4-(4-ethylpiperazin-1-yl)-4-oxobutyl]-3-methyl-1-phenylpyrazolo[3,4-b][1,4]thiazin-5-one Traditional Name: 4-[4-(4-ethylpiperazino)-4-keto-butyl]-3-methyl-1-phenyl-pyrazolo[3,4-b][1,4]thiazin-5-one Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CCCN2C(=O)CSC3=C2C(=NN3C4=CC=CC=C4)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)CCCN2C(=O)CSC3=C2C(=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C22H29N5O2S/c1-3-24-12-14-25(15-13-24)19(28)10-7-11-26-20(29)16-30-22-21(26)17(2)23-27(22)18-8-5-4-6-9-18/h4-6,8-9H,3,7,10-16H2,1-2H3