1-(4-butylphenyl)-3-[2-(4-nitrophenyl)ethanoylamino]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[2-(4-nitrophenyl)ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O3S/c1-2-3-4-14-5-9-16(10-6-14)20-19(27)22-21-18(24)13-15-7-11-17(12-8-15)23(25)26/h5-12H,2-4,13H2,1H3,(H,21,24)(H2,20,22,27)