6-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]phenanthridine

Systemtic Name: 6-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]phenanthridine Openeye Name: 6-[[4-(2-thienylsulfonyl)piperazin-1-yl]methyl]phenanthridine CAS Name: 6-[(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]phenanthridine IUPAC Name: 6-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]phenanthridine Traditional Name: 6-[[4-(2-thienylsulfonyl)piperazino]methyl]phenanthridine Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C4=CC=CC=C42)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C4=CC=CC=C42)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H21N3O2S2/c26-29(27,22-10-5-15-28-22)25-13-11-24(12-14-25)16-21-19-8-2-1-6-17(19)18-7-3-4-9-20(18)23-21/h1-10,15H,11-14,16H2