butyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]benzoate

Systemtic Name: butyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]benzoate Openeye Name: butyl 4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]benzoate CAS Name: 4-[[(2-methoxy-5-methylanilino)-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2-methoxy-5-methylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-methoxy-5-methyl-phenyl)thiocarbamoylamino]benzoic acid butyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C20H24N2O3S/c1-4-5-12-25-19(23)15-7-9-16(10-8-15)21-20(26)22-17-13-14(2)6-11-18(17)24-3/h6-11,13H,4-5,12H2,1-3H3,(H2,21,22,26)