N-(2-chloranyl-5-methylsulfonyl-phenyl)-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-1-ethyl-benzotriazole-5-carboxamide Formula: C16H15ClN4O3S MolecularWeight: 378.8333

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl)N=N1

InChI

InChI=1S/C16H15ClN4O3S/c1-3-21-15-7-4-10(8-14(15)19-20-21)16(22)18-13-9-11(25(2,23)24)5-6-12(13)17/h4-9H,3H2,1-2H3,(H,18,22)