N-(2,6-dimethylphenyl)-2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine

Systemtic Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine CAS Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-ethylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: (2,6-dimethylphenyl)-[2-[1-[4-(4-ethylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]amine Formula: C30H35N5O2S MolecularWeight: 529.6962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=C(C=CC=C5C)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=C(C=CC=C5C)C

InChI

InChI=1S/C30H35N5O2S/c1-5-24-13-15-25(16-14-24)38(36,37)35-19-17-34(18-20-35)23(4)29-31-27-12-7-6-11-26(27)30(33-29)32-28-21(2)9-8-10-22(28)3/h6-16,23H,5,17-20H2,1-4H3,(H,31,32,33)