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

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)-3-(3-methoxypropyl)thiourea Openeye Name: 1-(2-methoxy-5-nitro-phenyl)-3-(3-methoxypropyl)thiourea CAS Name: 1-(2-methoxy-5-nitrophenyl)-3-(3-methoxypropyl)thiourea IUPAC Name: 1-(2-methoxy-5-nitrophenyl)-3-(3-methoxypropyl)thiourea Traditional Name: 1-(2-methoxy-5-nitro-phenyl)-3-(3-methoxypropyl)thiourea Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O4S/c1-18-7-3-6-13-12(20)14-10-8-9(15(16)17)4-5-11(10)19-2/h4-5,8H,3,6-7H2,1-2H3,(H2,13,14,20)