1-[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propyl]-1,2,4-triazol-3-amine

Systemtic Name: 1-[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propyl]-1,2,4-triazol-3-amine Openeye Name: 1-[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propyl]-1,2,4-triazol-3-amine CAS Name: 1-[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propyl]-1,2,4-triazol-3-amine IUPAC Name: 1-[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propyl]-1,2,4-triazol-3-amine Traditional Name: [1-[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl]-1,2,4-triazol-3-yl]amine Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4C=NC(=N4)N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4C=NC(=N4)N)C

InChI

InChI=1S/C19H21N5OS/c1-13-8-9-17-18(14(13)2)24(11-5-10-23-12-21-19(20)22-23)15-6-3-4-7-16(15)26(17)25/h3-4,6-9,12H,5,10-11H2,1-2H3,(H2,20,22)