(E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxo-ethyl]thiazol-2-yl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxoethyl]-2-thiazolyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxoethyl]-1,3-thiazol-2-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-[2-(1H-benzimidazol-2-ylmethylamino)-2-keto-ethyl]thiazol-2-yl]-3-phenyl-acrylamide Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC2=NC(=CS2)CC(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC2=NC(=CS2)CC(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H19N5O2S/c28-20(11-10-15-6-2-1-3-7-15)27-22-24-16(14-30-22)12-21(29)23-13-19-25-17-8-4-5-9-18(17)26-19/h1-11,14H,12-13H2,(H,23,29)(H,25,26)(H,24,27,28)/b11-10+