ethyl 2-[2-oxidanylidene-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]sulfanyl-2-phenyl-ethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]sulfanyl-2-phenyl-ethanoate Openeye Name: ethyl 2-[2-oxo-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]sulfanyl-2-phenyl-acetate CAS Name: 2-[[2-oxo-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]sulfanyl-2-phenylacetate Traditional Name: 2-[[2-keto-2-[5-(5-phenyl-1,3,4-thiadiazol-2-yl)pentylamino]ethyl]thio]-2-phenyl-acetic acid ethyl ester Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SCC(=O)NCCCCCC2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)SCC(=O)NCCCCCC2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C25H29N3O3S2/c1-2-31-25(30)23(19-12-6-3-7-13-19)32-18-21(29)26-17-11-5-10-16-22-27-28-24(33-22)20-14-8-4-9-15-20/h3-4,6-9,12-15,23H,2,5,10-11,16-18H2,1H3,(H,26,29)