2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-cyclohexyloxy-quinazoline

Systemtic Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-cyclohexyloxy-quinazoline Openeye Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-(cyclohexoxy)quinazoline CAS Name: 2-[1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-cyclohexyloxyquinazoline IUPAC Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethyl]-4-cyclohexyloxyquinazoline Traditional Name: 2-[1-[4-(4-tert-butylphenyl)sulfonylpiperazino]ethyl]-4-(cyclohexoxy)quinazoline Formula: C30H40N4O3S MolecularWeight: 536.7286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)OC3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)OC3CCCCC3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C30H40N4O3S/c1-22(28-31-27-13-9-8-12-26(27)29(32-28)37-24-10-6-5-7-11-24)33-18-20-34(21-19-33)38(35,36)25-16-14-23(15-17-25)30(2,3)4/h8-9,12-17,22,24H,5-7,10-11,18-21H2,1-4H3