(E)-N-(6-acetamido-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-(6-acetamido-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-(6-acetamido-3-allyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)prop-2-enamide CAS Name: (E)-N-(6-acetamido-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-(6-acetamido-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-(6-acetamido-3-allyl-1,3-benzothiazol-2-ylidene)-3-(2-chlorophenyl)acrylamide Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C=CC3=CC=CC=C3Cl)S2)CC=C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)/C=C/C3=CC=CC=C3Cl)S2)CC=C

InChI

InChI=1S/C21H18ClN3O2S/c1-3-12-25-18-10-9-16(23-14(2)26)13-19(18)28-21(25)24-20(27)11-8-15-6-4-5-7-17(15)22/h3-11,13H,1,12H2,2H3,(H,23,26)/b11-8+,24-21?