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

Systemtic Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-4-cyclohexyloxy-quinazoline Openeye Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-4-(cyclohexoxy)quinazoline CAS Name: 2-[1-[4-(4-butoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-4-cyclohexyloxyquinazoline IUPAC Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-4-cyclohexyloxyquinazoline Traditional Name: 2-[1-[4-(4-butoxyphenyl)sulfonylpiperazino]ethyl]-4-(cyclohexoxy)quinazoline Formula: C30H40N4O4S MolecularWeight: 552.728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)OC5CCCCC5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)OC5CCCCC5

InChI

InChI=1S/C30H40N4O4S/c1-3-4-22-37-24-14-16-26(17-15-24)39(35,36)34-20-18-33(19-21-34)23(2)29-31-28-13-9-8-12-27(28)30(32-29)38-25-10-6-5-7-11-25/h8-9,12-17,23,25H,3-7,10-11,18-22H2,1-2H3