ethyl 4-[(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)carbamoylamino]benzoate

Systemtic Name: ethyl 4-[(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)carbamoylamino]benzoate Openeye Name: ethyl 4-[(3-allylsulfanyl-1,2,4-thiadiazol-5-yl)carbamoylamino]benzoate CAS Name: 4-[[oxo-[[3-(prop-2-enylthio)-1,2,4-thiadiazol-5-yl]amino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-prop-2-enylsulfanyl-1,2,4-thiadiazol-5-yl)carbamoylamino]benzoate Traditional Name: 4-[[3-(allylthio)-1,2,4-thiadiazol-5-yl]carbamoylamino]benzoic acid ethyl ester Formula: C15H16N4O3S2 MolecularWeight: 364.44254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=NC(=NS2)SCC=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=NC(=NS2)SCC=C

InChI

InChI=1S/C15H16N4O3S2/c1-3-9-23-15-18-14(24-19-15)17-13(21)16-11-7-5-10(6-8-11)12(20)22-4-2/h3,5-8H,1,4,9H2,2H3,(H2,16,17,18,19,21)