N-methyl-N-[2-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-methyl-N-[2-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-methyl-N-[2-[[3-[2-(2-thienyl)ethynyl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-methyl-N-[2-[oxo-[3-(2-thiophen-2-ylethynyl)anilino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-methyl-N-[2-[[3-(2-thiophen-2-ylethynyl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-methyl-N-[2-[[3-[2-(2-thienyl)ethynyl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C25H18N2O2S2 MolecularWeight: 442.55262

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C(=O)C4=CC=CS4

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H18N2O2S2/c1-27(25(29)23-12-6-16-31-23)22-11-3-2-10-21(22)24(28)26-19-8-4-7-18(17-19)13-14-20-9-5-15-30-20/h2-12,15-17H,1H3,(H,26,28)