2-[4-(3-propan-2-ylsulfonylpiperazin-1-yl)-3-propyl-phenyl]phenol

Systemtic Name: 2-[4-(3-propan-2-ylsulfonylpiperazin-1-yl)-3-propyl-phenyl]phenol Openeye Name: 2-[4-(3-isopropylsulfonylpiperazin-1-yl)-3-propyl-phenyl]phenol CAS Name: 2-[4-(3-propan-2-ylsulfonyl-1-piperazinyl)-3-propylphenyl]phenol IUPAC Name: 2-[4-(3-propan-2-ylsulfonylpiperazin-1-yl)-3-propylphenyl]phenol Traditional Name: 2-[4-(3-isopropylsulfonylpiperazino)-3-propyl-phenyl]phenol Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H30N2O3S/c1-4-7-18-14-17(19-8-5-6-9-21(19)25)10-11-20(18)24-13-12-23-22(15-24)28(26,27)16(2)3/h5-6,8-11,14,16,22-23,25H,4,7,12-13,15H2,1-3H3