10-[[4-(2,4-dichlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]phenothiazine

Systemtic Name: 10-[[4-(2,4-dichlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]phenothiazine Openeye Name: 10-[[5-allylsulfanyl-4-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]methyl]phenothiazine CAS Name: 10-[[4-(2,4-dichlorophenyl)-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]methyl]phenothiazine IUPAC Name: 10-[[4-(2,4-dichlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]methyl]phenothiazine Traditional Name: 10-[[5-(allylthio)-4-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]methyl]phenothiazine Formula: C24H18Cl2N4S2 MolecularWeight: 497.46252

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1C2=C(C=C(C=C2)Cl)Cl)CN3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C=CCSC1=NN=C(N1C2=C(C=C(C=C2)Cl)Cl)CN3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C24H18Cl2N4S2/c1-2-13-31-24-28-27-23(30(24)18-12-11-16(25)14-17(18)26)15-29-19-7-3-5-9-21(19)32-22-10-6-4-8-20(22)29/h2-12,14H,1,13,15H2