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

Systemtic Name: 1-[(2-chloranyl-5-nitro-phenyl)carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(2-chloro-5-nitro-benzoyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[(2-chloro-5-nitrophenyl)-oxomethyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(2-chloro-5-nitrobenzoyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(2-chloro-5-nitro-benzoyl)amino]-3-p-anisyl-thiourea Formula: C16H15ClN4O4S MolecularWeight: 394.8327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN4O4S/c1-25-12-5-2-10(3-6-12)9-18-16(26)20-19-15(22)13-8-11(21(23)24)4-7-14(13)17/h2-8H,9H2,1H3,(H,19,22)(H2,18,20,26)