N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[[(E)-3-phenylacryloyl]amino]propionamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H20N4O3S/c1-13(22-19(27)11-8-15-6-4-3-5-7-15)20(28)25-21-24-17-10-9-16(23-14(2)26)12-18(17)29-21/h3-13H,1-2H3,(H,22,27)(H,23,26)(H,24,25,28)/b11-8+