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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)NC3=CC=CC=C3OC)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=CC=C3OC)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)24-16-14-23(15-17-24)31(2,3)4)29-32-26-11-7-6-10-25(26)30(34-29)33-27-12-8-9-13-28(27)39-5/h6-17,22H,18-21H2,1-5H3,(H,32,33,34)