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

Systemtic Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-phenethyl-quinazolin-4-amine Openeye Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-phenethyl-quinazolin-4-amine CAS Name: 2-[1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]ethyl]-N-phenethyl-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-phenethylquinazolin-4-amine Traditional Name: [2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-phenethyl-amine Formula: C32H39N5O2S MolecularWeight: 557.74936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C32H39N5O2S/c1-24(36-20-22-37(23-21-36)40(38,39)27-16-14-26(15-17-27)32(2,3)4)30-34-29-13-9-8-12-28(29)31(35-30)33-19-18-25-10-6-5-7-11-25/h5-17,24H,18-23H2,1-4H3,(H,33,34,35)