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

Systemtic Name: 3-[[5-(3-methylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-propan-1-one Openeye Name: 3-[[5-(m-tolyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-propan-1-one CAS Name: 3-[[5-(3-methylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-(10-phenothiazinyl)-1-propanone IUPAC Name: 3-[[5-(3-methylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-ylpropan-1-one Traditional Name: 3-[[5-(m-tolyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-1-phenothiazin-10-yl-propan-1-one Formula: C31H26N4OS2 MolecularWeight: 534.69434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC(=CC=C6)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC(=CC=C6)C

InChI

InChI=1S/C31H26N4OS2/c1-21-14-16-24(17-15-21)34-30(23-9-7-8-22(2)20-23)32-33-31(34)37-19-18-29(36)35-25-10-3-5-12-27(25)38-28-13-6-4-11-26(28)35/h3-17,20H,18-19H2,1-2H3