1-(2-ethyl-6-methyl-phenyl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-(4-nitrophenyl)thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-(4-nitrophenyl)thiourea Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H17N3O2S/c1-3-12-6-4-5-11(2)15(12)18-16(22)17-13-7-9-14(10-8-13)19(20)21/h4-10H,3H2,1-2H3,(H2,17,18,22)