N-[[4-[2-(4-nitrophenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide

Systemtic Name: N-[[4-[2-(4-nitrophenoxy)ethanoylamino]phenyl]carbamothioyl]propanamide Openeye Name: N-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]anilino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]carbamothioyl]propanamide Traditional Name: N-[[4-[[2-(4-nitrophenoxy)acetyl]amino]phenyl]thiocarbamoyl]propionamide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c1-2-16(23)21-18(28)20-13-5-3-12(4-6-13)19-17(24)11-27-15-9-7-14(8-10-15)22(25)26/h3-10H,2,11H2,1H3,(H,19,24)(H2,20,21,23,28)