methyl 3-(4-methoxyphenyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Openeye Name: methyl 3-(4-methoxyphenyl)-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate CAS Name: 3-(4-methoxyphenyl)-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methoxyphenyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Traditional Name: 3-(4-methoxyphenyl)-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propionic acid methyl ester Formula: C14H16N4O4S2 MolecularWeight: 368.43124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)NC2=NNC(=S)S2

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)NC2=NNC(=S)S2

InChI

InChI=1S/C14H16N4O4S2/c1-21-9-5-3-8(4-6-9)7-10(11(19)22-2)15-12(20)16-13-17-18-14(23)24-13/h3-6,10H,7H2,1-2H3,(H,18,23)(H2,15,16,17,20)