ethyl 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylate Openeye Name: ethyl 2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylate CAS Name: 2-[[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-[[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]furan-3-carboxylic acid ethyl ester Formula: C13H17N3O3S2 MolecularWeight: 327.42238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CSC2=NN=C(S2)NC(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CSC2=NN=C(S2)NC(C)C

InChI

InChI=1S/C13H17N3O3S2/c1-4-18-11(17)9-5-6-19-10(9)7-20-13-16-15-12(21-13)14-8(2)3/h5-6,8H,4,7H2,1-3H3,(H,14,15)