N-(5-chloranyl-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)ethanamide

Systemtic Name: N-(5-chloranyl-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)ethanamide Openeye Name: N-(5-chloro-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)acetamide CAS Name: N-(5-chloro-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)acetamide IUPAC Name: N-(5-chloro-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)acetamide Traditional Name: N-(5-chloro-1,3-benzothiazol-2-yl)-2-(3-phenylpropylsulfonyl)acetamide Formula: C18H17ClN2O3S2 MolecularWeight: 408.92218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCS(=O)(=O)CC(=O)NC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCCS(=O)(=O)CC(=O)NC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H17ClN2O3S2/c19-14-8-9-16-15(11-14)20-18(25-16)21-17(22)12-26(23,24)10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,20,21,22)