1-(3-methylphenyl)-3-(2-nitro-5-propylsulfanyl-phenyl)thiourea

Systemtic Name: 1-(3-methylphenyl)-3-(2-nitro-5-propylsulfanyl-phenyl)thiourea Openeye Name: 1-(m-tolyl)-3-(2-nitro-5-propylsulfanyl-phenyl)thiourea CAS Name: 1-(3-methylphenyl)-3-[2-nitro-5-(propylthio)phenyl]thiourea IUPAC Name: 1-(3-methylphenyl)-3-(2-nitro-5-propylsulfanylphenyl)thiourea Traditional Name: 1-(m-tolyl)-3-[2-nitro-5-(propylthio)phenyl]thiourea Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC(=C2)C

Isomeric SMILES

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC(=C2)C

InChI

InChI=1S/C17H19N3O2S2/c1-3-9-24-14-7-8-16(20(21)22)15(11-14)19-17(23)18-13-6-4-5-12(2)10-13/h4-8,10-11H,3,9H2,1-2H3,(H2,18,19,23)