(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-[(5-methylthiophen-2-yl)carbonylamino]ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-[(5-methylthiophene-2-carbonyl)amino]acetate CAS Name: 2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-[(5-methylthiophene-2-carbonyl)amino]acetate Traditional Name: 2-[(5-methylthiophene-2-carbonyl)amino]acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O4S2/c1-14-10-11-19(29-14)22(27)23-12-21(26)28-13-20(25)24-15-6-2-4-8-17(15)30-18-9-5-3-7-16(18)24/h2-11H,12-13H2,1H3,(H,23,27)