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

Systemtic Name: N-cyclohexyl-2-[1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: N-cyclohexyl-2-[1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine CAS Name: N-cyclohexyl-2-[1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-cyclohexyl-2-[1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: cyclohexyl-[2-[1-[4-(4-propylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]amine Formula: C29H39N5O2S MolecularWeight: 521.71726

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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)NC5CCCCC5

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5CCCCC5

InChI

InChI=1S/C29H39N5O2S/c1-3-9-23-14-16-25(17-15-23)37(35,36)34-20-18-33(19-21-34)22(2)28-31-27-13-8-7-12-26(27)29(32-28)30-24-10-5-4-6-11-24/h7-8,12-17,22,24H,3-6,9-11,18-21H2,1-2H3,(H,30,31,32)