1-(3-chlorophenyl)-3-[(4-ethoxy-3-nitro-phenyl)carbonylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[(4-ethoxy-3-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[(4-ethoxy-3-nitro-benzoyl)amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[(4-ethoxy-3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[(4-ethoxy-3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[(4-ethoxy-3-nitro-benzoyl)amino]thiourea Formula: C16H15ClN4O4S MolecularWeight: 394.8327

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NNC(=S)NC2=CC(=CC=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN4O4S/c1-2-25-14-7-6-10(8-13(14)21(23)24)15(22)19-20-16(26)18-12-5-3-4-11(17)9-12/h3-9H,2H2,1H3,(H,19,22)(H2,18,20,26)