propan-2-yl 2,5-bis(chloranyl)thiophene-3-carboxylate; propan-2-yl 2,5-dipyridin-4-ylthiophene-3-carboxylate

Systemtic Name: propan-2-yl 2,5-bis(chloranyl)thiophene-3-carboxylate; propan-2-yl 2,5-dipyridin-4-ylthiophene-3-carboxylate Openeye Name: isopropyl 2,5-bis(4-pyridyl)thiophene-3-carboxylate; isopropyl 2,5-dichlorothiophene-3-carboxylate CAS Name: 2,5-dichloro-3-thiophenecarboxylic acid propan-2-yl ester; 2,5-dipyridin-4-yl-3-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,5-dichlorothiophene-3-carboxylate; propan-2-yl 2,5-dipyridin-4-ylthiophene-3-carboxylate Traditional Name: 2,5-bis(4-pyridyl)thiophene-3-carboxylic acid isopropyl ester; 2,5-dichlorothiophene-3-carboxylic acid isopropyl ester Formula: C26H24Cl2N2O4S2 MolecularWeight: 563.51576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(SC(=C1)C2=CC=NC=C2)C3=CC=NC=C3.CC(C)OC(=O)C1=C(SC(=C1)Cl)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(SC(=C1)C2=CC=NC=C2)C3=CC=NC=C3.CC(C)OC(=O)C1=C(SC(=C1)Cl)Cl

InChI

InChI=1S/C18H16N2O2S.C8H8Cl2O2S/c1-12(2)22-18(21)15-11-16(13-3-7-19-8-4-13)23-17(15)14-5-9-20-10-6-14;1-4(2)12-8(11)5-3-6(9)13-7(5)10/h3-12H,1-2H3;3-4H,1-2H3