2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole

Systemtic Name: 2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Openeye Name: 2-[[4-(5-methylsulfonylpentyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-thiazole CAS Name: 2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-5-nitrothiazole IUPAC Name: 2-[[4-(5-methylsulfonylpentyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-5-nitro-1,3-thiazole Traditional Name: 2-[[4-(5-mesylpentyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-5-nitro-thiazole Formula: C15H17N5O4S4 MolecularWeight: 459.58658

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCCN1C(=NN=C1SC2=NC=C(S2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)CCCCCN1C(=NN=C1SC2=NC=C(S2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C15H17N5O4S4/c1-28(23,24)9-4-2-3-7-19-13(11-6-5-8-25-11)17-18-14(19)27-15-16-10-12(26-15)20(21)22/h5-6,8,10H,2-4,7,9H2,1H3