4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(2-thienyl)butan-1-one CAS Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[[4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-1-(2-thienyl)butan-1-one Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=NN=C2SCCCC(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=CC=C1N2C=NN=C2SCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C17H17N3O2S2/c1-22-15-8-3-2-6-13(15)20-12-18-19-17(20)24-11-4-7-14(21)16-9-5-10-23-16/h2-3,5-6,8-10,12H,4,7,11H2,1H3