[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(2,6-dimethylanilino)-2-oxo-ethyl] 5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-5-oxo-pentanoate CAS Name: 5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-5-oxopentanoic acid [2-(2,6-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylanilino)-2-oxoethyl] 5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-5-oxopentanoate Traditional Name: 5-keto-5-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]valeric acid [2-(2,6-dimethylanilino)-2-keto-ethyl] ester Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)CCCC(=O)NC2=NN=C(S2)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)COC(=O)CCCC(=O)NC2=NN=C(S2)C

InChI

InChI=1S/C18H22N4O4S/c1-11-6-4-7-12(2)17(11)19-15(24)10-26-16(25)9-5-8-14(23)20-18-22-21-13(3)27-18/h4,6-7H,5,8-10H2,1-3H3,(H,19,24)(H,20,22,23)