2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(6-chloranylbenzotriazol-1-yl)oxy-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(6-chloro-1-benzotriazolyl)oxy]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(6-chlorobenzotriazol-1-yl)oxy-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C18H18ClN5O4S MolecularWeight: 435.88462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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