ethyl 2,4-dimethyl-5-[2-(3-phenothiazin-10-ylpropanoyloxy)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(3-phenothiazin-10-ylpropanoyloxy)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(3-phenothiazin-10-ylpropanoyloxy)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[1-oxo-3-(10-phenothiazinyl)propoxy]ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(3-phenothiazin-10-ylpropanoyloxy)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(3-phenothiazin-10-ylpropanoyloxy)acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)C

InChI

InChI=1S/C26H26N2O5S/c1-4-32-26(31)24-16(2)25(27-17(24)3)20(29)15-33-23(30)13-14-28-18-9-5-7-11-21(18)34-22-12-8-6-10-19(22)28/h5-12,27H,4,13-15H2,1-3H3