propyl 4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[(4-methoxy-3-nitro-phenyl)carbonylcarbamothioylamino]benzoate Openeye Name: propyl 4-[(4-methoxy-3-nitro-benzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(4-methoxy-3-nitrobenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-methoxy-3-nitro-benzoyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H19N3O6S/c1-3-10-28-18(24)12-4-7-14(8-5-12)20-19(29)21-17(23)13-6-9-16(27-2)15(11-13)22(25)26/h4-9,11H,3,10H2,1-2H3,(H2,20,21,23,29)