(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-(5-methyl-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-methyl-2-thiophenyl)-4-oxobutanoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-(5-methylthiophen-2-yl)-4-oxobutanoate Traditional Name: 4-keto-4-(5-methyl-2-thienyl)butyric acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C23H19NO4S2 MolecularWeight: 437.53126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C23H19NO4S2/c1-15-10-12-21(29-15)18(25)11-13-23(27)28-14-22(26)24-16-6-2-4-8-19(16)30-20-9-5-3-7-17(20)24/h2-10,12H,11,13-14H2,1H3