1-(4-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(3-nitrophenyl)carbonylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(3-nitrobenzoyl)amino]thiourea Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3S/c1-2-3-5-13-8-10-15(11-9-13)19-18(26)21-20-17(23)14-6-4-7-16(12-14)22(24)25/h4,6-12H,2-3,5H2,1H3,(H,20,23)(H2,19,21,26)