N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-morpholinosulfonyl-benzenesulfonamide Formula: C18H18ClN5O5S2 MolecularWeight: 483.94902

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)N4C=NC=N4

InChI

InChI=1S/C18H18ClN5O5S2/c19-14-1-6-18(24-13-20-12-21-24)17(11-14)22-30(25,26)15-2-4-16(5-3-15)31(27,28)23-7-9-29-10-8-23/h1-6,11-13,22H,7-10H2