diethyl 2-[5-azanyl-4-(2-chlorophenyl)carbonyl-thiophen-2-yl]propanedioate

Systemtic Name: diethyl 2-[5-azanyl-4-(2-chlorophenyl)carbonyl-thiophen-2-yl]propanedioate Openeye Name: diethyl 2-[5-amino-4-(2-chlorobenzoyl)-2-thienyl]propanedioate CAS Name: 2-[5-amino-4-[(2-chlorophenyl)-oxomethyl]-2-thiophenyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[5-amino-4-(2-chlorobenzoyl)thiophen-2-yl]propanedioate Traditional Name: 2-[5-amino-4-(2-chlorobenzoyl)-2-thienyl]malonic acid diethyl ester Formula: C18H18ClNO5S MolecularWeight: 395.85722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(S1)N)C(=O)C2=CC=CC=C2Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=CC(=C(S1)N)C(=O)C2=CC=CC=C2Cl)C(=O)OCC

InChI

InChI=1S/C18H18ClNO5S/c1-3-24-17(22)14(18(23)25-4-2)13-9-11(16(20)26-13)15(21)10-7-5-6-8-12(10)19/h5-9,14H,3-4,20H2,1-2H3