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

Systemtic Name: 1-[(4-chlorophenyl)methyl]-3-[(3-methyl-4-nitro-phenyl)carbonylamino]thiourea Openeye Name: 1-[(4-chlorophenyl)methyl]-3-[(3-methyl-4-nitro-benzoyl)amino]thiourea CAS Name: 1-[(4-chlorophenyl)methyl]-3-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(4-chlorophenyl)methyl]-3-[(3-methyl-4-nitrobenzoyl)amino]thiourea Traditional Name: 1-(4-chlorobenzyl)-3-[(3-methyl-4-nitro-benzoyl)amino]thiourea Formula: C16H15ClN4O3S MolecularWeight: 378.8333

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NNC(=S)NCC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN4O3S/c1-10-8-12(4-7-14(10)21(23)24)15(22)19-20-16(25)18-9-11-2-5-13(17)6-3-11/h2-8H,9H2,1H3,(H,19,22)(H2,18,20,25)