N-(1-methylpyrazol-3-yl)-4,6-bis(2-thiophen-3-ylethoxy)pyrimidine-2-carboxamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-4,6-bis(2-thiophen-3-ylethoxy)pyrimidine-2-carboxamide Openeye Name: N-(1-methylpyrazol-3-yl)-4,6-bis[2-(3-thienyl)ethoxy]pyrimidine-2-carboxamide CAS Name: N-(1-methyl-3-pyrazolyl)-4,6-bis[2-(3-thiophenyl)ethoxy]-2-pyrimidinecarboxamide IUPAC Name: N-(1-methylpyrazol-3-yl)-4,6-bis(2-thiophen-3-ylethoxy)pyrimidine-2-carboxamide Traditional Name: N-(1-methylpyrazol-3-yl)-4,6-bis[2-(3-thienyl)ethoxy]pyrimidine-2-carboxamide Formula: C21H21N5O3S2 MolecularWeight: 455.55314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=NC(=CC(=N2)OCCC3=CSC=C3)OCCC4=CSC=C4

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=NC(=CC(=N2)OCCC3=CSC=C3)OCCC4=CSC=C4

InChI

InChI=1S/C21H21N5O3S2/c1-26-7-2-17(25-26)22-21(27)20-23-18(28-8-3-15-5-10-30-13-15)12-19(24-20)29-9-4-16-6-11-31-14-16/h2,5-7,10-14H,3-4,8-9H2,1H3,(H,22,25,27)