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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NCCC5=CC=CC=C5

Isomeric SMILES

CCCC1=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/c1-3-9-25-14-16-27(17-15-25)39(37,38)36-22-20-35(21-23-36)24(2)30-33-29-13-8-7-12-28(29)31(34-30)32-19-18-26-10-5-4-6-11-26/h4-8,10-17,24H,3,9,18-23H2,1-2H3,(H,32,33,34)