(E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acrylamide Formula: C18H17N3O3S2 MolecularWeight: 387.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C=CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C=C/C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H17N3O3S2/c19-26(23,24)14-7-5-13(6-8-14)11-12-20-17(22)9-10-18-21-15-3-1-2-4-16(15)25-18/h1-10H,11-12H2,(H,20,22)(H2,19,23,24)/b10-9+