methyl 4-[[5-[(5-ethyl-4-methyl-thiophen-2-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[5-[(5-ethyl-4-methyl-thiophen-2-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[5-[(5-ethyl-4-methyl-thiophene-2-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[5-[[(5-ethyl-4-methyl-2-thiophenyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-[(5-ethyl-4-methylthiophene-2-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[5-[(5-ethyl-4-methyl-thiophene-2-carbonyl)amino]-1,3,4-thiadiazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C19H19N3O3S3 MolecularWeight: 433.56746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C19H19N3O3S3/c1-4-14-11(2)9-15(27-14)16(23)20-18-21-22-19(28-18)26-10-12-5-7-13(8-6-12)17(24)25-3/h5-9H,4,10H2,1-3H3,(H,20,21,23)