1-[(6-chloranylpyridin-3-yl)methyl]-4-(4-ethoxyphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(6-chloranylpyridin-3-yl)methyl]-4-(4-ethoxyphenyl)sulfonyl-piperazine Openeye Name: 1-[(6-chloro-3-pyridyl)methyl]-4-(4-ethoxyphenyl)sulfonyl-piperazine CAS Name: 1-[(6-chloro-3-pyridinyl)methyl]-4-(4-ethoxyphenyl)sulfonylpiperazine IUPAC Name: 1-[(6-chloropyridin-3-yl)methyl]-4-(4-ethoxyphenyl)sulfonylpiperazine Traditional Name: 1-[(6-chloro-3-pyridyl)methyl]-4-p-phenetylsulfonyl-piperazine Formula: C18H22ClN3O3S MolecularWeight: 395.90358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CN=C(C=C3)Cl

InChI

InChI=1S/C18H22ClN3O3S/c1-2-25-16-4-6-17(7-5-16)26(23,24)22-11-9-21(10-12-22)14-15-3-8-18(19)20-13-15/h3-8,13H,2,9-12,14H2,1H3