ethyl 2-[5-(3-methylbutanoylamino)-1,3,4-thiadiazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-(3-methylbutanoylamino)-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(3-methylbutanoylamino)-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[(3-methyl-1-oxobutyl)amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(3-methylbutanoylamino)-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-(isovalerylamino)-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC(=O)CC(C)C

InChI

InChI=1S/C11H17N3O3S/c1-4-17-10(16)6-9-13-14-11(18-9)12-8(15)5-7(2)3/h7H,4-6H2,1-3H3,(H,12,14,15)