(2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-phenothiazin-10-ylpropanoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 3-phenothiazin-10-ylpropanoate Openeye Name: (2-anilinothiazol-4-yl)methyl 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid (2-anilinothiazol-4-yl)methyl ester Formula: C25H21N3O2S2 MolecularWeight: 459.58314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H21N3O2S2/c29-24(30-16-19-17-31-25(27-19)26-18-8-2-1-3-9-18)14-15-28-20-10-4-6-12-22(20)32-23-13-7-5-11-21(23)28/h1-13,17H,14-16H2,(H,26,27)