3-(1,3-benzothiazol-2-yl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(5-ethylsulfonyl-2-hydroxy-phenyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(5-esyl-2-hydroxy-phenyl)propionamide Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O4S2/c1-2-26(23,24)12-7-8-15(21)14(11-12)19-17(22)9-10-18-20-13-5-3-4-6-16(13)25-18/h3-8,11,21H,2,9-10H2,1H3,(H,19,22)