2-azanyl-3-(4-imidazol-1-ylphenyl)-4-prop-2-enoyl-benzenesulfonamide

Systemtic Name: 2-azanyl-3-(4-imidazol-1-ylphenyl)-4-prop-2-enoyl-benzenesulfonamide Openeye Name: 2-amino-3-(4-imidazol-1-ylphenyl)-4-prop-2-enoyl-benzenesulfonamide CAS Name: 2-amino-3-[4-(1-imidazolyl)phenyl]-4-(1-oxoprop-2-enyl)benzenesulfonamide IUPAC Name: 2-amino-3-(4-imidazol-1-ylphenyl)-4-prop-2-enoylbenzenesulfonamide Traditional Name: 4-acryloyl-2-amino-3-(4-imidazol-1-ylphenyl)benzenesulfonamide Formula: C18H16N4O3S MolecularWeight: 368.40964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)C1=C(C(=C(C=C1)S(=O)(=O)N)N)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

C=CC(=O)C1=C(C(=C(C=C1)S(=O)(=O)N)N)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C18H16N4O3S/c1-2-15(23)14-7-8-16(26(20,24)25)18(19)17(14)12-3-5-13(6-4-12)22-10-9-21-11-22/h2-11H,1,19H2,(H2,20,24,25)