butyl 4-[(4-methoxyphenyl)methylcarbamothioylamino]benzoate

Systemtic Name: butyl 4-[(4-methoxyphenyl)methylcarbamothioylamino]benzoate Openeye Name: butyl 4-[(4-methoxyphenyl)methylcarbamothioylamino]benzoate CAS Name: 4-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-methoxyphenyl)methylcarbamothioylamino]benzoate Traditional Name: 4-(p-anisylthiocarbamoylamino)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)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H24N2O3S/c1-3-4-13-25-19(23)16-7-9-17(10-8-16)22-20(26)21-14-15-5-11-18(24-2)12-6-15/h5-12H,3-4,13-14H2,1-2H3,(H2,21,22,26)