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

Systemtic Name: N-[5-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide Openeye Name: N-[5-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide CAS Name: N-[5-[[2-(4-bromoanilino)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methylbenzamide IUPAC Name: N-[5-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methylbenzamide Traditional Name: N-[5-[[2-(4-bromoanilino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-3-methyl-benzamide Formula: C18H15BrN4O2S2 MolecularWeight: 463.3713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrN4O2S2/c1-11-3-2-4-12(9-11)16(25)21-17-22-23-18(27-17)26-10-15(24)20-14-7-5-13(19)6-8-14/h2-9H,10H2,1H3,(H,20,24)(H,21,22,25)