1-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea

Systemtic Name: 1-[(5-chloranyl-2-nitro-phenyl)carbonylamino]-3-(2-ethyl-6-methyl-phenyl)thiourea Openeye Name: 1-[(5-chloro-2-nitro-benzoyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea CAS Name: 1-[[(5-chloro-2-nitrophenyl)-oxomethyl]amino]-3-(2-ethyl-6-methylphenyl)thiourea IUPAC Name: 1-[(5-chloro-2-nitrobenzoyl)amino]-3-(2-ethyl-6-methylphenyl)thiourea Traditional Name: 1-[(5-chloro-2-nitro-benzoyl)amino]-3-(2-ethyl-6-methyl-phenyl)thiourea Formula: C17H17ClN4O3S MolecularWeight: 392.85988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C17H17ClN4O3S/c1-3-11-6-4-5-10(2)15(11)19-17(26)21-20-16(23)13-9-12(18)7-8-14(13)22(24)25/h4-9H,3H2,1-2H3,(H,20,23)(H2,19,21,26)