2-(4-ethylsulfonylpiperazin-1-yl)-N-(phenylmethyl)quinazolin-4-amine

Systemtic Name: 2-(4-ethylsulfonylpiperazin-1-yl)-N-(phenylmethyl)quinazolin-4-amine Openeye Name: N-benzyl-2-(4-ethylsulfonylpiperazin-1-yl)quinazolin-4-amine CAS Name: 2-(4-ethylsulfonyl-1-piperazinyl)-N-(phenylmethyl)-4-quinazolinamine IUPAC Name: N-benzyl-2-(4-ethylsulfonylpiperazin-1-yl)quinazolin-4-amine Traditional Name: benzyl-[2-(4-esylpiperazino)quinazolin-4-yl]amine Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NCC4=CC=CC=C4

InChI

InChI=1S/C21H25N5O2S/c1-2-29(27,28)26-14-12-25(13-15-26)21-23-19-11-7-6-10-18(19)20(24-21)22-16-17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3,(H,22,23,24)