S-[4-methyl-5-(5-methylthiophen-2-yl)-1,2,4-triazol-3-yl] 4-propoxybenzenecarbothioate

Systemtic Name: S-[4-methyl-5-(5-methylthiophen-2-yl)-1,2,4-triazol-3-yl] 4-propoxybenzenecarbothioate Openeye Name: S-[4-methyl-5-(5-methyl-2-thienyl)-1,2,4-triazol-3-yl] 4-propoxybenzenecarbothioate CAS Name: 4-propoxybenzenecarbothioic acid S-[4-methyl-5-(5-methyl-2-thiophenyl)-1,2,4-triazol-3-yl] ester IUPAC Name: S-[4-methyl-5-(5-methylthiophen-2-yl)-1,2,4-triazol-3-yl] 4-propoxybenzenecarbothioate Traditional Name: 4-propoxythiobenzoic acid S-[4-methyl-5-(5-methyl-2-thienyl)-1,2,4-triazol-3-yl] ester Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)SC2=NN=C(N2C)C3=CC=C(S3)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)SC2=NN=C(N2C)C3=CC=C(S3)C

InChI

InChI=1S/C18H19N3O2S2/c1-4-11-23-14-8-6-13(7-9-14)17(22)25-18-20-19-16(21(18)3)15-10-5-12(2)24-15/h5-10H,4,11H2,1-3H3