2-(4-nitrophenoxy)-N-[(4-phenylazanylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-nitrophenoxy)-N-[(4-phenylazanylphenyl)carbamothioyl]ethanamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O4S/c26-20(14-29-19-12-10-18(11-13-19)25(27)28)24-21(30)23-17-8-6-16(7-9-17)22-15-4-2-1-3-5-15/h1-13,22H,14H2,(H2,23,24,26,30)