2-bromanyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-bromanyl-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-bromo-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-bromo-N-[6-(1-pyrrolidinylsulfonyl)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 2-bromo-N-(6-pyrrolidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-bromo-N-(6-pyrrolidinosulfonyl-1,3-benzothiazol-2-yl)propionamide Formula: C14H16BrN3O3S2 MolecularWeight: 418.32914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)Br

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCCC3)Br

InChI

InChI=1S/C14H16BrN3O3S2/c1-9(15)13(19)17-14-16-11-5-4-10(8-12(11)22-14)23(20,21)18-6-2-3-7-18/h4-5,8-9H,2-3,6-7H2,1H3,(H,16,17,19)