2-[[5-[(4-methylphenyl)sulfonylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole

Systemtic Name: 2-[[5-[(4-methylphenyl)sulfonylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Openeye Name: 5-nitro-2-[[4-phenyl-5-(p-tolylsulfonylmethyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole CAS Name: 2-[[5-[(4-methylphenyl)sulfonylmethyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-5-nitrothiazole IUPAC Name: 2-[[5-[(4-methylphenyl)sulfonylmethyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Traditional Name: 5-nitro-2-[[4-phenyl-5-(tosylmethyl)-1,2,4-triazol-3-yl]thio]thiazole Formula: C19H15N5O4S3 MolecularWeight: 473.5485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(N2C3=CC=CC=C3)SC4=NC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=NN=C(N2C3=CC=CC=C3)SC4=NC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O4S3/c1-13-7-9-15(10-8-13)31(27,28)12-16-21-22-18(23(16)14-5-3-2-4-6-14)30-19-20-11-17(29-19)24(25)26/h2-11H,12H2,1H3