4-(2-methoxyphenyl)-3-(3-phenylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-(2-methoxyphenyl)-3-(3-phenylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-(2-methoxyphenyl)-3-(3-phenylpropylsulfanyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-(2-methoxyphenyl)-3-(3-phenylpropylthio)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-(2-methoxyphenyl)-3-(3-phenylpropylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-(2-methoxyphenyl)-3-(3-phenylpropylthio)-5-(2-thienyl)-1,2,4-triazole Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCCCC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H21N3OS2/c1-26-19-13-6-5-12-18(19)25-21(20-14-8-15-27-20)23-24-22(25)28-16-7-11-17-9-3-2-4-10-17/h2-6,8-10,12-15H,7,11,16H2,1H3