4-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(4-methoxyphenyl)-3-methyl-piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(4-methoxyphenyl)-3-methyl-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(4-methoxyphenyl)-3-methyl-piperazino]sulfonylbenzonitrile Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H21N3O3S/c1-15-14-21(26(23,24)19-9-3-16(13-20)4-10-19)11-12-22(15)17-5-7-18(25-2)8-6-17/h3-10,15H,11-12,14H2,1-2H3