methyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-ethyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-4-ethyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-ethyl-thiazole-5-carboxylate CAS Name: 2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-ethyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-4-ethyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[(3-chlorobenzothiophene-2-carbonyl)amino]-4-ethyl-thiazole-5-carboxylic acid methyl ester Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)OC

Isomeric SMILES

CCC1=C(SC(=N1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)OC

InChI

InChI=1S/C16H13ClN2O3S2/c1-3-9-12(15(21)22-2)24-16(18-9)19-14(20)13-11(17)8-6-4-5-7-10(8)23-13/h4-7H,3H2,1-2H3,(H,18,19,20)