4-(4-methylphenyl)sulfonyl-5-prop-2-ynylsulfanyl-1,3-thiazole

Systemtic Name: 4-(4-methylphenyl)sulfonyl-5-prop-2-ynylsulfanyl-1,3-thiazole Openeye Name: 5-prop-2-ynylsulfanyl-4-(p-tolylsulfonyl)thiazole CAS Name: 4-(4-methylphenyl)sulfonyl-5-(prop-2-ynylthio)thiazole IUPAC Name: 4-(4-methylphenyl)sulfonyl-5-prop-2-ynylsulfanyl-1,3-thiazole Traditional Name: 5-(propargylthio)-4-tosyl-thiazole Formula: C13H11NO2S3 MolecularWeight: 309.42694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC=N2)SCC#C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(SC=N2)SCC#C

InChI

InChI=1S/C13H11NO2S3/c1-3-8-17-13-12(14-9-18-13)19(15,16)11-6-4-10(2)5-7-11/h1,4-7,9H,8H2,2H3