3-(4,5-dimethylthiophen-3-yl)-5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-(4,5-dimethylthiophen-3-yl)-5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(4,5-dimethyl-3-thienyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4,5-dimethyl-3-thiophenyl)-5-[(3-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(4,5-dimethylthiophen-3-yl)-5-[(3-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(4,5-dimethyl-3-thienyl)-5-(m-anisylthio)-1,2,4-triazole Formula: C19H21N3OS2 MolecularWeight: 371.51954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1C2=NN=C(N2CC=C)SCC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(SC=C1C2=NN=C(N2CC=C)SCC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C19H21N3OS2/c1-5-9-22-18(17-12-24-14(3)13(17)2)20-21-19(22)25-11-15-7-6-8-16(10-15)23-4/h5-8,10,12H,1,9,11H2,2-4H3