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

Systemtic Name: N-[1-[5-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide Openeye Name: N-[1-[5-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide CAS Name: N-[1-[5-[[2-(4-bromoanilino)-2-oxoethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-methoxybenzamide IUPAC Name: N-[1-[5-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-methoxybenzamide Traditional Name: N-[1-[5-[[2-(4-bromoanilino)-2-keto-ethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]-4-methoxy-benzamide Formula: C22H24BrN5O3S MolecularWeight: 518.42666

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C(C)NC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Br)C(C)NC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24BrN5O3S/c1-4-28-20(14(2)24-21(30)15-5-11-18(31-3)12-6-15)26-27-22(28)32-13-19(29)25-17-9-7-16(23)8-10-17/h5-12,14H,4,13H2,1-3H3,(H,24,30)(H,25,29)