hexadecyl 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: hexadecyl 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxidanylidene-butanoate Openeye Name: hexadecyl 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxo-butanoate CAS Name: 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoic acid hexadecyl ester IUPAC Name: hexadecyl 4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-4-oxobutanoate Traditional Name: 4-keto-4-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]butyric acid cetyl ester Formula: C23H41N3O3S MolecularWeight: 439.65494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CCC(=O)NC1=NN=C(S1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CCC(=O)NC1=NN=C(S1)C

InChI

InChI=1S/C23H41N3O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-29-22(28)18-17-21(27)24-23-26-25-20(2)30-23/h3-19H2,1-2H3,(H,24,26,27)