4-butyl-2-chloranyl-6-[3-(2-chloranyl-6-thiophen-2-yl-pyrimidin-4-yl)thiophen-2-yl]pyrimidine

Systemtic Name: 4-butyl-2-chloranyl-6-[3-(2-chloranyl-6-thiophen-2-yl-pyrimidin-4-yl)thiophen-2-yl]pyrimidine Openeye Name: 4-butyl-2-chloro-6-[3-[2-chloro-6-(2-thienyl)pyrimidin-4-yl]-2-thienyl]pyrimidine CAS Name: 4-butyl-2-chloro-6-[3-(2-chloro-6-thiophen-2-yl-4-pyrimidinyl)-2-thiophenyl]pyrimidine IUPAC Name: 4-butyl-2-chloro-6-[3-(2-chloro-6-thiophen-2-ylpyrimidin-4-yl)thiophen-2-yl]pyrimidine Traditional Name: 4-butyl-2-chloro-6-[3-[2-chloro-6-(2-thienyl)pyrimidin-4-yl]-2-thienyl]pyrimidine Formula: C20H16Cl2N4S2 MolecularWeight: 447.40384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NC(=C1)C2=C(C=CS2)C3=CC(=NC(=N3)Cl)C4=CC=CS4)Cl

Isomeric SMILES

CCCCC1=NC(=NC(=C1)C2=C(C=CS2)C3=CC(=NC(=N3)Cl)C4=CC=CS4)Cl

InChI

InChI=1S/C20H16Cl2N4S2/c1-2-3-5-12-10-16(26-19(21)23-12)18-13(7-9-28-18)14-11-15(25-20(22)24-14)17-6-4-8-27-17/h4,6-11H,2-3,5H2,1H3