1-(2-chloranyl-5-nitro-phenyl)-3-[(4-ethoxyphenyl)carbonylamino]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[(4-ethoxyphenyl)carbonylamino]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[(4-ethoxybenzoyl)amino]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[(4-ethoxyphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[(4-ethoxybenzoyl)amino]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[(4-ethoxybenzoyl)amino]thiourea Formula: C16H15ClN4O4S MolecularWeight: 394.8327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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