1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea Openeye Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[2-(4-nitroanilino)ethyl]thiourea CAS Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[2-(4-nitroanilino)ethyl]thiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[2-(4-nitroanilino)ethyl]thiourea Traditional Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[2-(4-nitroanilino)ethyl]thiourea Formula: C17H19ClN4O2S MolecularWeight: 378.87636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H19ClN4O2S/c1-11-9-12(2)16(15(18)10-11)21-17(25)20-8-7-19-13-3-5-14(6-4-13)22(23)24/h3-6,9-10,19H,7-8H2,1-2H3,(H2,20,21,25)