(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-[5-(1-piperidylsulfonyl)-2-thienyl]acetate CAS Name: 2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(5-piperidin-1-ylsulfonylthiophen-2-yl)acetate Traditional Name: 2-(5-piperidinosulfonyl-2-thienyl)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H24N2O5S3 MolecularWeight: 528.66346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H24N2O5S3/c28-23(27-19-8-2-4-10-21(19)34-22-11-5-3-9-20(22)27)17-32-24(29)16-18-12-13-25(33-18)35(30,31)26-14-6-1-7-15-26/h2-5,8-13H,1,6-7,14-17H2