ethyl 4-[[4-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]-3-methyl-phenyl]-2-methyl-phenyl]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[4-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]-3-methyl-phenyl]-2-methyl-phenyl]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[4-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]-3-methyl-phenyl]-2-methyl-phenyl]carbamothioylamino]benzoate CAS Name: 4-[[[4-[4-[[(4-ethoxycarbonylanilino)-sulfanylidenemethyl]amino]-3-methylphenyl]-2-methylanilino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]-3-methylphenyl]-2-methylphenyl]carbamothioylamino]benzoate Traditional Name: 4-[[4-[4-[(4-carbethoxyphenyl)thiocarbamoylamino]-3-methyl-phenyl]-2-methyl-phenyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C34H34N4O4S2 MolecularWeight: 626.78816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)C3=CC(=C(C=C3)NC(=S)NC4=CC=C(C=C4)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(C=C2)C3=CC(=C(C=C3)NC(=S)NC4=CC=C(C=C4)C(=O)OCC)C)C

InChI

InChI=1S/C34H34N4O4S2/c1-5-41-31(39)23-7-13-27(14-8-23)35-33(43)37-29-17-11-25(19-21(29)3)26-12-18-30(22(4)20-26)38-34(44)36-28-15-9-24(10-16-28)32(40)42-6-2/h7-20H,5-6H2,1-4H3,(H2,35,37,43)(H2,36,38,44)