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

Systemtic Name: 1-(3-methoxypropyl)-3-(2-methyl-5-nitro-phenyl)thiourea Openeye Name: 1-(3-methoxypropyl)-3-(2-methyl-5-nitro-phenyl)thiourea CAS Name: 1-(3-methoxypropyl)-3-(2-methyl-5-nitrophenyl)thiourea IUPAC Name: 1-(3-methoxypropyl)-3-(2-methyl-5-nitrophenyl)thiourea Traditional Name: 1-(3-methoxypropyl)-3-(2-methyl-5-nitro-phenyl)thiourea Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NCCCOC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NCCCOC

InChI

InChI=1S/C12H17N3O3S/c1-9-4-5-10(15(16)17)8-11(9)14-12(19)13-6-3-7-18-2/h4-5,8H,3,6-7H2,1-2H3,(H2,13,14,19)