ethyl 2-[2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxidanylidene-pyrimidin-1-yl]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxo-pyrimidin-1-yl]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-[(2-chlorophenyl)methylthio]-4-methyl-6-oxo-1-pyrimidinyl]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-[(2-chlorophenyl)methylsulfanyl]-4-methyl-6-oxopyrimidin-1-yl]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-[(2-chlorobenzyl)thio]-6-keto-4-methyl-pyrimidin-1-yl]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H24ClN3O4S2 MolecularWeight: 554.08016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3C(=O)C=C(N=C3SCC4=CC=CC=C4Cl)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN3C(=O)C=C(N=C3SCC4=CC=CC=C4Cl)C

InChI

InChI=1S/C27H24ClN3O4S2/c1-3-35-26(34)24-20(18-9-5-4-6-10-18)16-36-25(24)30-22(32)14-31-23(33)13-17(2)29-27(31)37-15-19-11-7-8-12-21(19)28/h4-13,16H,3,14-15H2,1-2H3,(H,30,32)