1-(4-butan-2-ylphenyl)-3-(4-methoxy-2-nitro-phenyl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(4-methoxy-2-nitro-phenyl)thiourea Openeye Name: 1-(4-methoxy-2-nitro-phenyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(4-methoxy-2-nitrophenyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(4-methoxy-2-nitrophenyl)thiourea Traditional Name: 1-(4-methoxy-2-nitro-phenyl)-3-(4-sec-butylphenyl)thiourea Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3S/c1-4-12(2)13-5-7-14(8-6-13)19-18(25)20-16-10-9-15(24-3)11-17(16)21(22)23/h5-12H,4H2,1-3H3,(H2,19,20,25)