1-(2-methyl-5-nitro-phenyl)-3-undecyl-thiourea

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)-3-undecyl-thiourea Openeye Name: 1-(2-methyl-5-nitro-phenyl)-3-undecyl-thiourea CAS Name: 1-(2-methyl-5-nitrophenyl)-3-undecylthiourea IUPAC Name: 1-(2-methyl-5-nitrophenyl)-3-undecylthiourea Traditional Name: 1-(2-methyl-5-nitro-phenyl)-3-undecyl-thiourea Formula: C19H31N3O2S MolecularWeight: 365.53334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])C

InChI

InChI=1S/C19H31N3O2S/c1-3-4-5-6-7-8-9-10-11-14-20-19(25)21-18-15-17(22(23)24)13-12-16(18)2/h12-13,15H,3-11,14H2,1-2H3,(H2,20,21,25)