1-(4-butan-2-ylphenyl)-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(3-nitrophenyl)thiourea Openeye Name: 1-(3-nitrophenyl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(3-nitrophenyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(3-nitrophenyl)thiourea Traditional Name: 1-(3-nitrophenyl)-3-(4-sec-butylphenyl)thiourea Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O2S/c1-3-12(2)13-7-9-14(10-8-13)18-17(23)19-15-5-4-6-16(11-15)20(21)22/h4-12H,3H2,1-2H3,(H2,18,19,23)