N-[5-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate

Systemtic Name: N-[5-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate Openeye Name: N-[5-[2-(3-bromoanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate CAS Name: N-[5-[[2-(3-bromoanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate IUPAC Name: N-[5-[2-(3-bromoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate Traditional Name: N-[5-[[2-(3-bromoanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxy-formimidate Formula: C13H12BrN4O3S2- MolecularWeight: 416.29338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)Br)[O-]

Isomeric SMILES

CCOC(=NC1=NN=C(S1)SCC(=O)NC2=CC(=CC=C2)Br)[O-]

InChI

InChI=1S/C13H13BrN4O3S2/c1-2-21-12(20)16-11-17-18-13(23-11)22-7-10(19)15-9-5-3-4-8(14)6-9/h3-6H,2,7H2,1H3,(H,15,19)(H,16,17,20)/p-1