4-[(propan-2-ylcarbamoylamino)methyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide

Systemtic Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide CAS Name: 4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide IUPAC Name: 4-[(propan-2-ylcarbamoylamino)methyl]-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzamide Formula: C24H23N3O2S MolecularWeight: 417.52332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C24H23N3O2S/c1-17(2)26-24(29)25-16-19-8-11-20(12-9-19)23(28)27-21-6-3-5-18(15-21)10-13-22-7-4-14-30-22/h3-9,11-12,14-15,17H,16H2,1-2H3,(H,27,28)(H2,25,26,29)