[2-oxidanylidene-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]propanoate

Systemtic Name: [2-oxidanylidene-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-[5-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]propanoate Openeye Name: [2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-(5-bromo-2,3-dioxo-indolin-1-yl)propanoate CAS Name: 2-(5-bromo-2,3-dioxo-1-indolyl)propanoic acid [2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] 2-(5-bromo-2,3-dioxoindol-1-yl)propanoate Traditional Name: 2-(5-bromo-2,3-diketo-indolin-1-yl)propionic acid [2-keto-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl] ester Formula: C18H17BrN4O5S MolecularWeight: 481.32038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)COC(=O)C(C)N2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)COC(=O)C(C)N2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C18H17BrN4O5S/c1-3-4-14-21-22-18(29-14)20-13(24)8-28-17(27)9(2)23-12-6-5-10(19)7-11(12)15(25)16(23)26/h5-7,9H,3-4,8H2,1-2H3,(H,20,22,24)