2-[(4-methylphenyl)sulfonylmethyl]-6-nitro-N-phenyl-quinazolin-4-amine

Systemtic Name: 2-[(4-methylphenyl)sulfonylmethyl]-6-nitro-N-phenyl-quinazolin-4-amine Openeye Name: 6-nitro-N-phenyl-2-(p-tolylsulfonylmethyl)quinazolin-4-amine CAS Name: 2-[(4-methylphenyl)sulfonylmethyl]-6-nitro-N-phenyl-4-quinazolinamine IUPAC Name: 2-[(4-methylphenyl)sulfonylmethyl]-6-nitro-N-phenylquinazolin-4-amine Traditional Name: [6-nitro-2-(tosylmethyl)quinazolin-4-yl]-phenyl-amine Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)NC4=CC=CC=C4

InChI

InChI=1S/C22H18N4O4S/c1-15-7-10-18(11-8-15)31(29,30)14-21-24-20-12-9-17(26(27)28)13-19(20)22(25-21)23-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,23,24,25)