N-[4-[5-(acetamidomethyl)thiophen-2-yl]-5-methyl-1,3-thiazol-2-yl]-4-(2-phenylethynyl)benzamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-5-methyl-1,3-thiazol-2-yl]-4-(2-phenylethynyl)benzamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]-5-methyl-thiazol-2-yl]-4-(2-phenylethynyl)benzamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-5-methyl-2-thiazolyl]-4-(2-phenylethynyl)benzamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-5-methyl-1,3-thiazol-2-yl]-4-(2-phenylethynyl)benzamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]-5-methyl-thiazol-2-yl]-4-(2-phenylethynyl)benzamide Formula: C26H21N3O2S2 MolecularWeight: 471.59384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3)C4=CC=C(S4)CNC(=O)C

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3)C4=CC=C(S4)CNC(=O)C

InChI

InChI=1S/C26H21N3O2S2/c1-17-24(23-15-14-22(33-23)16-27-18(2)30)28-26(32-17)29-25(31)21-12-10-20(11-13-21)9-8-19-6-4-3-5-7-19/h3-7,10-15H,16H2,1-2H3,(H,27,30)(H,28,29,31)