1-[[4-(4-methoxyphenyl)-5-(phenothiazin-10-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-one

Systemtic Name: 1-[[4-(4-methoxyphenyl)-5-(phenothiazin-10-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Openeye Name: 1-[[4-(4-methoxyphenyl)-5-(phenothiazin-10-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-one CAS Name: 1-[[4-(4-methoxyphenyl)-5-(10-phenothiazinylmethyl)-1,2,4-triazol-3-yl]thio]-2-propanone IUPAC Name: 1-[[4-(4-methoxyphenyl)-5-(phenothiazin-10-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-one Traditional Name: 1-[[4-(4-methoxyphenyl)-5-(phenothiazin-10-ylmethyl)-1,2,4-triazol-3-yl]thio]acetone Formula: C25H22N4O2S2 MolecularWeight: 474.59778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)CN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)CN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H22N4O2S2/c1-17(30)16-32-25-27-26-24(29(25)18-11-13-19(31-2)14-12-18)15-28-20-7-3-5-9-22(20)33-23-10-6-4-8-21(23)28/h3-14H,15-16H2,1-2H3