N-[2-(5-azanyl-7-bromanyl-4-chloranyl-benzotriazol-2-yl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]ethanamide

Systemtic Name: N-[2-(5-azanyl-7-bromanyl-4-chloranyl-benzotriazol-2-yl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]ethanamide Openeye Name: N-[2-(5-amino-7-bromo-4-chloro-benzotriazol-2-yl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]acetamide CAS Name: N-[2-(5-amino-7-bromo-4-chloro-2-benzotriazolyl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxyphenyl]acetamide IUPAC Name: N-[2-(5-amino-7-bromo-4-chlorobenzotriazol-2-yl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxyphenyl]acetamide Traditional Name: N-[2-(5-amino-7-bromo-4-chloro-benzotriazol-2-yl)-5-[2-cyanoethyl(ethyl)amino]-4-methoxy-phenyl]acetamide Formula: C20H21BrClN7O2 MolecularWeight: 506.78344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC#N)C1=C(C=C(C(=C1)NC(=O)C)N2N=C3C(=CC(=C(C3=N2)Cl)N)Br)OC

Isomeric SMILES

CCN(CCC#N)C1=C(C=C(C(=C1)NC(=O)C)N2N=C3C(=CC(=C(C3=N2)Cl)N)Br)OC

InChI

InChI=1S/C20H21BrClN7O2/c1-4-28(7-5-6-23)16-9-14(25-11(2)30)15(10-17(16)31-3)29-26-19-12(21)8-13(24)18(22)20(19)27-29/h8-10H,4-5,7,24H2,1-3H3,(H,25,30)