3-imidazol-1-yl-1-[2-methoxy-5,5-bis(oxidanylidene)phenothiazin-10-yl]propan-1-one

Systemtic Name: 3-imidazol-1-yl-1-[2-methoxy-5,5-bis(oxidanylidene)phenothiazin-10-yl]propan-1-one Openeye Name: 3-imidazol-1-yl-1-(2-methoxy-5,5-dioxo-phenothiazin-10-yl)propan-1-one CAS Name: 3-(1-imidazolyl)-1-(2-methoxy-5,5-dioxo-10-phenothiazinyl)-1-propanone IUPAC Name: 3-imidazol-1-yl-1-(2-methoxy-5,5-dioxophenothiazin-10-yl)propan-1-one Traditional Name: 1-(5,5-diketo-2-methoxy-phenothiazin-10-yl)-3-imidazol-1-yl-propan-1-one Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3N2C(=O)CCN4C=CN=C4

Isomeric SMILES

COC1=CC2=C(C=C1)S(=O)(=O)C3=CC=CC=C3N2C(=O)CCN4C=CN=C4

InChI

InChI=1S/C19H17N3O4S/c1-26-14-6-7-18-16(12-14)22(19(23)8-10-21-11-9-20-13-21)15-4-2-3-5-17(15)27(18,24)25/h2-7,9,11-13H,8,10H2,1H3