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

Systemtic Name: ethyl 2-[5-[(4-bromophenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-[(4-bromobenzoyl)amino]-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[[(4-bromophenyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(4-bromobenzoyl)amino]-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-[(4-bromobenzoyl)amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C13H12BrN3O3S MolecularWeight: 370.22168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H12BrN3O3S/c1-2-20-11(18)7-10-16-17-13(21-10)15-12(19)8-3-5-9(14)6-4-8/h3-6H,2,7H2,1H3,(H,15,17,19)