(E)-N-[2-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[2-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[2-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[2-[[2-oxo-2-(2-oxolanylmethylamino)ethyl]thio]-1,3-benzothiazol-6-yl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[2-[[2-keto-2-(tetrahydrofurfurylamino)ethyl]thio]-1,3-benzothiazol-6-yl]-3-phenyl-acrylamide Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3S2/c27-21(11-8-16-5-2-1-3-6-16)25-17-9-10-19-20(13-17)31-23(26-19)30-15-22(28)24-14-18-7-4-12-29-18/h1-3,5-6,8-11,13,18H,4,7,12,14-15H2,(H,24,28)(H,25,27)/b11-8+