2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine

Systemtic Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-ethylphenyl)sulfonyl-1-piperazinyl]ethyl]-N-(3-methoxyphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-ethylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(3-methoxyphenyl)amine Formula: C29H33N5O3S MolecularWeight: 531.66902

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=CC(=CC=C5)OC

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC(=CC=C5)OC

InChI

InChI=1S/C29H33N5O3S/c1-4-22-12-14-25(15-13-22)38(35,36)34-18-16-33(17-19-34)21(2)28-31-27-11-6-5-10-26(27)29(32-28)30-23-8-7-9-24(20-23)37-3/h5-15,20-21H,4,16-19H2,1-3H3,(H,30,31,32)