ethyl 4-[(4-butylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-butylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-butylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(4-butylanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-butylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-butylphenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C20H24N2O2S/c1-3-5-6-15-7-11-17(12-8-15)21-20(25)22-18-13-9-16(10-14-18)19(23)24-4-2/h7-14H,3-6H2,1-2H3,(H2,21,22,25)