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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)C(C)OC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

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