1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine

Systemtic Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine Openeye Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-pyridylmethyl)piperazine CAS Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine IUPAC Name: 1-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-4-(pyridin-4-ylmethyl)piperazine Traditional Name: 1-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-4-(4-pyridylmethyl)piperazine Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)CC3=CC=NC=C3)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)N2CCN(CC2)CC3=CC=NC=C3)C)C)OC

InChI

InChI=1S/C20H27N3O3S/c1-15-13-19(26-4)16(2)17(3)20(15)27(24,25)23-11-9-22(10-12-23)14-18-5-7-21-8-6-18/h5-8,13H,9-12,14H2,1-4H3