6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]nicotinonitrile Formula: C18H20N4O4S MolecularWeight: 388.4408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=C3)C#N)OC

InChI

InChI=1S/C18H20N4O4S/c1-25-16-5-4-15(11-17(16)26-2)27(23,24)22-9-7-21(8-10-22)18-6-3-14(12-19)13-20-18/h3-6,11,13H,7-10H2,1-2H3