1-(5-methylthiophen-2-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-methylthiophen-2-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-1-(5-methyl-2-thienyl)ethanone CAS Name: 1-(5-methyl-2-thiophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(5-methylthiophen-2-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-1-(5-methyl-2-thienyl)ethanone Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CSC2=NN=CN2CC=C

Isomeric SMILES

CC1=CC=C(S1)C(=O)CSC2=NN=CN2CC=C

InChI

InChI=1S/C12H13N3OS2/c1-3-6-15-8-13-14-12(15)17-7-10(16)11-5-4-9(2)18-11/h3-5,8H,1,6-7H2,2H3