3-[(3-methoxyphenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-[(3-methoxyphenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-[(3-methoxyphenyl)methylsulfanyl]-4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-[(3-methoxyphenyl)methylthio]-4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-[(3-methoxyphenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-(m-anisylthio)-4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazole Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NN=C(N2CC3CCCO3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NN=C(N2CC3CCCO3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O2S2/c1-23-15-6-2-5-14(11-15)13-26-19-21-20-18(17-8-4-10-25-17)22(19)12-16-7-3-9-24-16/h2,4-6,8,10-11,16H,3,7,9,12-13H2,1H3