benzotriazol-1-yl-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)methanone

Systemtic Name: benzotriazol-1-yl-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)methanone Openeye Name: benzotriazol-1-yl-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)methanone CAS Name: 1-benzotriazolyl-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: benzotriazol-1-yl-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: benzotriazol-1-yl-(4-chloro-3-pyrrolidinosulfonyl-phenyl)methanone Formula: C17H15ClN4O3S MolecularWeight: 390.844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3C4=CC=CC=C4N=N3)Cl

InChI

InChI=1S/C17H15ClN4O3S/c18-13-8-7-12(11-16(13)26(24,25)21-9-3-4-10-21)17(23)22-15-6-2-1-5-14(15)19-20-22/h1-2,5-8,11H,3-4,9-10H2