3-chloranyl-2-methyl-N-[3-(phenylmethyl)sulfonylpropyl]pyrazolo[1,5-a]quinazolin-5-amine

Systemtic Name: 3-chloranyl-2-methyl-N-[3-(phenylmethyl)sulfonylpropyl]pyrazolo[1,5-a]quinazolin-5-amine Openeye Name: N-(3-benzylsulfonylpropyl)-3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-amine CAS Name: 3-chloro-2-methyl-N-[3-(phenylmethyl)sulfonylpropyl]-5-pyrazolo[1,5-a]quinazolinamine IUPAC Name: N-(3-benzylsulfonylpropyl)-3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-amine Traditional Name: 3-benzylsulfonylpropyl-(3-chloro-2-methyl-pyrazolo[1,5-a]quinazolin-5-yl)amine Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C3=CC=CC=C3C(=NC2=C1Cl)NCCCS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN2C3=CC=CC=C3C(=NC2=C1Cl)NCCCS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H21ClN4O2S/c1-15-19(22)21-24-20(17-10-5-6-11-18(17)26(21)25-15)23-12-7-13-29(27,28)14-16-8-3-2-4-9-16/h2-6,8-11H,7,12-14H2,1H3,(H,23,24)