4-[[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-ylidene]methyl]benzoate

Systemtic Name: 4-[[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-5-ylidene]methyl]benzoate Openeye Name: 4-[[3-allyl-2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-oxo-thiazolidin-5-ylidene]methyl]benzoate CAS Name: 4-[[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-oxo-3-prop-2-enyl-5-thiazolidinylidene]methyl]benzoate IUPAC Name: 4-[[2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-5-ylidene]methyl]benzoate Traditional Name: 4-[[3-allyl-2-[(5-ethyl-1,3,4-thiadiazol-2-yl)imino]-4-keto-thiazolidin-5-ylidene]methyl]benzoate Formula: C18H15N4O3S2- MolecularWeight: 399.4667

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)N=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])S2)CC=C

Isomeric SMILES

CCC1=NN=C(S1)N=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])S2)CC=C

InChI

InChI=1S/C18H16N4O3S2/c1-3-9-22-15(23)13(10-11-5-7-12(8-6-11)16(24)25)26-18(22)19-17-21-20-14(4-2)27-17/h3,5-8,10H,1,4,9H2,2H3,(H,24,25)/p-1