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

Systemtic Name: 2-[3-ethyl-4-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]phenol Openeye Name: 2-[3-ethyl-4-(3-isopropylsulfonylpiperazin-1-yl)phenyl]phenol CAS Name: 2-[3-ethyl-4-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]phenol IUPAC Name: 2-[3-ethyl-4-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]phenol Traditional Name: 2-[3-ethyl-4-(3-isopropylsulfonylpiperazino)phenyl]phenol Formula: C21H28N2O3S MolecularWeight: 388.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C21H28N2O3S/c1-4-16-13-17(18-7-5-6-8-20(18)24)9-10-19(16)23-12-11-22-21(14-23)27(25,26)15(2)3/h5-10,13,15,21-22,24H,4,11-12,14H2,1-3H3