5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline

Systemtic Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline Openeye Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-methyl-pyrazolo[1,5-a]quinazoline CAS Name: 5-[4-(1-azepanylsulfonyl)-1-piperazinyl]-2-methylpyrazolo[1,5-a]quinazoline IUPAC Name: 5-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]quinazoline Traditional Name: 5-[4-(azepan-1-ylsulfonyl)piperazino]-2-methyl-pyrazolo[1,5-a]quinazoline Formula: C21H28N6O2S MolecularWeight: 428.55102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1)N4CCN(CC4)S(=O)(=O)N5CCCCCC5

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1)N4CCN(CC4)S(=O)(=O)N5CCCCCC5

InChI

InChI=1S/C21H28N6O2S/c1-17-16-20-22-21(18-8-4-5-9-19(18)27(20)23-17)24-12-14-26(15-13-24)30(28,29)25-10-6-2-3-7-11-25/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3