2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-chloranylphenothiazin-10-yl)ethanone

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-chloranylphenothiazin-10-yl)ethanone Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-chlorophenothiazin-10-yl)ethanone CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-chloro-10-phenothiazinyl)ethanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-chlorophenothiazin-10-yl)ethanone Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-chlorophenothiazin-10-yl)ethanone Formula: C16H12ClN5OS2 MolecularWeight: 389.88238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)CSC4=NNC(=N4)N

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)CSC4=NNC(=N4)N

InChI

InChI=1S/C16H12ClN5OS2/c17-9-5-6-13-11(7-9)22(10-3-1-2-4-12(10)25-13)14(23)8-24-16-19-15(18)20-21-16/h1-7H,8H2,(H3,18,19,20,21)