5-(phenylmethyl)-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxamide

Systemtic Name: 5-(phenylmethyl)-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxamide CAS Name: 2-[(1-oxo-3-phenylprop-2-ynyl)amino]-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-(3-phenylprop-2-ynoylamino)thiophene-3-carboxamide Traditional Name: 5-benzyl-2-[(3-phenylpropioloyl)amino]thiophene-3-carboxamide Formula: C21H16N2O2S MolecularWeight: 360.42894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)C#CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)C#CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H16N2O2S/c22-20(25)18-14-17(13-16-9-5-2-6-10-16)26-21(18)23-19(24)12-11-15-7-3-1-4-8-15/h1-10,14H,13H2,(H2,22,25)(H,23,24)