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

Systemtic Name: N-phenethyl-2-[1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: 2-[1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-phenethyl-quinazolin-4-amine CAS Name: N-phenethyl-2-[1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-phenethyl-2-[1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: [2-[1-(4-p-cumenylsulfonylpiperazino)ethyl]quinazolin-4-yl]-phenethyl-amine Formula: C31H37N5O2S MolecularWeight: 543.72278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H37N5O2S/c1-23(2)26-13-15-27(16-14-26)39(37,38)36-21-19-35(20-22-36)24(3)30-33-29-12-8-7-11-28(29)31(34-30)32-18-17-25-9-5-4-6-10-25/h4-16,23-24H,17-22H2,1-3H3,(H,32,33,34)