N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromanyl-5-(cyclopropylsulfamoyl)benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromanyl-5-(cyclopropylsulfamoyl)benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromo-5-(cyclopropylsulfamoyl)benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromo-5-(cyclopropylsulfamoyl)benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromo-5-(cyclopropylsulfamoyl)benzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-2-bromo-5-(cyclopropylsulfamoyl)benzamide Formula: C20H20BrN3O3S2 MolecularWeight: 494.4251

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20BrN3O3S2/c21-16-10-9-14(29(26,27)24-13-7-8-13)12-15(16)20(25)22-11-3-6-19-23-17-4-1-2-5-18(17)28-19/h1-2,4-5,9-10,12-13,24H,3,6-8,11H2,(H,22,25)