2-[[5-(3-phenylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-(3-phenylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(4-allyl-5-cinnamylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[5-(3-phenylprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[[5-(3-phenylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-allyl-5-(cinnamylthio)-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole Formula: C22H20N4S3 MolecularWeight: 436.616

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC=CC2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C=CCN1C(=NN=C1SCC=CC2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N4S3/c1-2-14-26-20(16-28-22-23-18-12-6-7-13-19(18)29-22)24-25-21(26)27-15-8-11-17-9-4-3-5-10-17/h2-13H,1,14-16H2