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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NCCC5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NCCC5=CC=CC=C5

InChI

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