ethyl 3-oxidanylidene-2-[[5-(phenothiazin-10-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butanoate

Systemtic Name: ethyl 3-oxidanylidene-2-[[5-(phenothiazin-10-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butanoate Openeye Name: ethyl 3-oxo-2-[[5-(phenothiazin-10-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butanoate CAS Name: 3-oxo-2-[[5-(10-phenothiazinylmethyl)-1,3,4-oxadiazol-2-yl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-2-[[5-(phenothiazin-10-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butanoate Traditional Name: 3-keto-2-[[5-(phenothiazin-10-ylmethyl)-1,3,4-oxadiazol-2-yl]thio]butyric acid ethyl ester Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=NN=C(O1)CN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=NN=C(O1)CN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C21H19N3O4S2/c1-3-27-20(26)19(13(2)25)30-21-23-22-18(28-21)12-24-14-8-4-6-10-16(14)29-17-11-7-5-9-15(17)24/h4-11,19H,3,12H2,1-2H3