ethyl N-[[4-[4-(ethoxycarbonylcarbamothioylamino)-3-methyl-phenyl]-2-methyl-phenyl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[4-[4-(ethoxycarbonylcarbamothioylamino)-3-methyl-phenyl]-2-methyl-phenyl]carbamothioyl]carbamate Openeye Name: ethyl N-[[4-[4-(ethoxycarbonylcarbamothioylamino)-3-methyl-phenyl]-2-methyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[4-[4-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-3-methylphenyl]-2-methylanilino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[4-[4-(ethoxycarbonylcarbamothioylamino)-3-methylphenyl]-2-methylphenyl]carbamothioyl]carbamate Traditional Name: N-[[4-[4-(carbethoxythiocarbamoylamino)-3-methyl-phenyl]-2-methyl-phenyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=S)NC(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)NC(=S)NC1=C(C=C(C=C1)C2=CC(=C(C=C2)NC(=S)NC(=O)OCC)C)C

InChI

InChI=1S/C22H26N4O4S2/c1-5-29-21(27)25-19(31)23-17-9-7-15(11-13(17)3)16-8-10-18(14(4)12-16)24-20(32)26-22(28)30-6-2/h7-12H,5-6H2,1-4H3,(H2,23,25,27,31)(H2,24,26,28,32)