methyl 5-oxidanylidene-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)pentanoate Openeye Name: methyl 5-oxo-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)pentanoate CAS Name: 5-oxo-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)pentanoate Traditional Name: 5-keto-5-(4-phenyl-5-phenylimino-1,3,4-thiadiazol-2-yl)valeric acid methyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)C1=NN(C(=NC2=CC=CC=C2)S1)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCCC(=O)C1=NN(C(=NC2=CC=CC=C2)S1)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3S/c1-26-18(25)14-8-13-17(24)19-22-23(16-11-6-3-7-12-16)20(27-19)21-15-9-4-2-5-10-15/h2-7,9-12H,8,13-14H2,1H3