2-[[5-(3,4-dimethylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[[4-allyl-5-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[[5-(3,4-dimethylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[[4-allyl-5-(3,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]-1-phenothiazin-10-yl-ethanone Formula: C27H24N4OS2 MolecularWeight: 484.63566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(N2CC=C)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C

InChI

InChI=1S/C27H24N4OS2/c1-4-15-30-26(20-14-13-18(2)19(3)16-20)28-29-27(30)33-17-25(32)31-21-9-5-7-11-23(21)34-24-12-8-6-10-22(24)31/h4-14,16H,1,15,17H2,2-3H3