methyl 3-chloranyl-5-[1-(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)-4-(methylcarbamothioylamino)but-1-enyl]-2-methoxy-benzoate

Systemtic Name: methyl 3-chloranyl-5-[1-(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)-4-(methylcarbamothioylamino)but-1-enyl]-2-methoxy-benzoate Openeye Name: methyl 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonyl-phenyl)-4-(methylcarbamothioylamino)but-1-enyl]-2-methoxy-benzoate CAS Name: 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonylphenyl)-4-[[methylamino(sulfanylidene)methyl]amino]but-1-enyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-chloro-5-[1-(3-chloro-4-methoxy-5-methoxycarbonylphenyl)-4-(methylcarbamothioylamino)but-1-enyl]-2-methoxybenzoate Traditional Name: 5-[1-(3-carbomethoxy-5-chloro-4-methoxy-phenyl)-4-(methylthiocarbamoylamino)but-1-enyl]-3-chloro-2-methoxy-benzoic acid methyl ester Formula: C24H26Cl2N2O6S MolecularWeight: 541.44404

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)OC)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC

Isomeric SMILES

CNC(=S)NCCC=C(C1=CC(=C(C(=C1)Cl)OC)C(=O)OC)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC

InChI

InChI=1S/C24H26Cl2N2O6S/c1-27-24(35)28-8-6-7-15(13-9-16(22(29)33-4)20(31-2)18(25)11-13)14-10-17(23(30)34-5)21(32-3)19(26)12-14/h7,9-12H,6,8H2,1-5H3,(H2,27,28,35)