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

Systemtic Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-butoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-N-(3-methoxyphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methoxyphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-butoxyphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(3-methoxyphenyl)amine Formula: C31H37N5O4S MolecularWeight: 575.72158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC(=CC=C5)OC

Isomeric SMILES

CCCCOC1=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/C31H37N5O4S/c1-4-5-21-40-25-13-15-27(16-14-25)41(37,38)36-19-17-35(18-20-36)23(2)30-33-29-12-7-6-11-28(29)31(34-30)32-24-9-8-10-26(22-24)39-3/h6-16,22-23H,4-5,17-21H2,1-3H3,(H,32,33,34)