2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-3-oxidanylidene-propanoyl]amino]benzoate

Systemtic Name: 2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-3-oxidanylidene-propanoyl]amino]benzoate Openeye Name: 2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-3-oxo-propanoyl]amino]benzoate CAS Name: 2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-1,3-dioxopropyl]amino]benzoate IUPAC Name: 2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-3-oxopropanoyl]amino]benzoate Traditional Name: 2-[[3-[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]-3-keto-propanoyl]amino]benzoate Formula: C14H13N4O4S- MolecularWeight: 333.34242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)CC(=O)NC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C14H14N4O4S/c1-2-12-17-18-14(23-12)16-11(20)7-10(19)15-9-6-4-3-5-8(9)13(21)22/h3-6H,2,7H2,1H3,(H,15,19)(H,21,22)(H,16,18,20)/p-1