N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(benzenesulfonyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-besyl-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

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