[2-(2-methylsulfanylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxo-ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-[2-(methylthio)-10-phenothiazinyl]-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfanylphenothiazin-10-yl)-2-oxoethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-keto-2-[2-(methylthio)phenothiazin-10-yl]ethyl] ester Formula: C22H19N3O3S3 MolecularWeight: 469.59956

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)COC(=O)C4=CSC(=N4)NCC=C

Isomeric SMILES

CSC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)COC(=O)C4=CSC(=N4)NCC=C

InChI

InChI=1S/C22H19N3O3S3/c1-3-10-23-22-24-15(13-30-22)21(27)28-12-20(26)25-16-6-4-5-7-18(16)31-19-9-8-14(29-2)11-17(19)25/h3-9,11,13H,1,10,12H2,2H3,(H,23,24)