2-(6-chloranylbenzotriazol-1-yl)oxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-chloranylbenzotriazol-1-yl)oxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(6-chloro-1-benzotriazolyl)oxy]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C18H18ClN5O4S MolecularWeight: 435.88462

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CON3C4=C(C=CC(=C4)Cl)N=N3

InChI

InChI=1S/C18H18ClN5O4S/c19-13-3-8-16-17(11-13)24(22-21-16)28-12-18(25)20-14-4-6-15(7-5-14)29(26,27)23-9-1-2-10-23/h3-8,11H,1-2,9-10,12H2,(H,20,25)