3-[3-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]benzenecarbonitrile

Systemtic Name: 3-[3-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]benzenecarbonitrile Openeye Name: 3-[3-(4-methylpiperazin-1-yl)benzothiophen-2-yl]benzonitrile CAS Name: 3-[3-(4-methyl-1-piperazinyl)-1-benzothiophen-2-yl]benzonitrile IUPAC Name: 3-[3-(4-methylpiperazin-1-yl)-1-benzothiophen-2-yl]benzonitrile Traditional Name: 3-[3-(4-methylpiperazino)benzothiophen-2-yl]benzonitrile Formula: C20H19N3S MolecularWeight: 333.44996

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(SC3=CC=CC=C32)C4=CC=CC(=C4)C#N

Isomeric SMILES

CN1CCN(CC1)C2=C(SC3=CC=CC=C32)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H19N3S/c1-22-9-11-23(12-10-22)19-17-7-2-3-8-18(17)24-20(19)16-6-4-5-15(13-16)14-21/h2-8,13H,9-12H2,1H3