N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide Openeye Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanamide IUPAC Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanamide Traditional Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-[[(E)-3-phenylacryloyl]amino]propionamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C(C)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C(C)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O2S/c1-3-4-10-16-21-22-18(25-16)20-17(24)13(2)19-15(23)12-11-14-8-6-5-7-9-14/h5-9,11-13H,3-4,10H2,1-2H3,(H,19,23)(H,20,22,24)/b12-11+