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

Systemtic Name: ethyl 2-[5-[(4-bromophenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-[(4-bromophenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]acetate CAS Name: 2-[5-[[(4-bromoanilino)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(4-bromophenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]acetate Traditional Name: 2-[5-[(4-bromophenyl)carbamoylamino]-1,3,4-thiadiazol-2-yl]acetic acid ethyl ester Formula: C13H13BrN4O3S MolecularWeight: 385.23632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)CC1=NN=C(S1)NC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H13BrN4O3S/c1-2-21-11(19)7-10-17-18-13(22-10)16-12(20)15-9-5-3-8(14)4-6-9/h3-6H,2,7H2,1H3,(H2,15,16,18,20)