2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methoxyphenyl)quinazolin-4-amine

Systemtic Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methoxyphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methoxyphenyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]ethyl]-N-(4-methoxyphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methoxyphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(4-methoxyphenyl)amine Formula: C31H37N5O3S MolecularWeight: 559.72218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)OC)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)OC)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C31H37N5O3S/c1-22(35-18-20-36(21-19-35)40(37,38)26-16-10-23(11-17-26)31(2,3)4)29-33-28-9-7-6-8-27(28)30(34-29)32-24-12-14-25(39-5)15-13-24/h6-17,22H,18-21H2,1-5H3,(H,32,33,34)