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

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)-3-propyl-thiourea Openeye Name: 1-(2-methyl-5-nitro-phenyl)-3-propyl-thiourea CAS Name: 1-(2-methyl-5-nitrophenyl)-3-propylthiourea IUPAC Name: 1-(2-methyl-5-nitrophenyl)-3-propylthiourea Traditional Name: 1-(2-methyl-5-nitro-phenyl)-3-propyl-thiourea Formula: C11H15N3O2S MolecularWeight: 253.3207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O2S/c1-3-6-12-11(17)13-10-7-9(14(15)16)5-4-8(10)2/h4-5,7H,3,6H2,1-2H3,(H2,12,13,17)