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

Systemtic Name: 1-(4-butylphenyl)-3-[2-(2-nitrophenoxy)ethanoylamino]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea Traditional Name: 1-(4-butylphenyl)-3-[[2-(2-nitrophenoxy)acetyl]amino]thiourea Formula: C19H22N4O4S MolecularWeight: 402.46738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4S/c1-2-3-6-14-9-11-15(12-10-14)20-19(28)22-21-18(24)13-27-17-8-5-4-7-16(17)23(25)26/h4-5,7-12H,2-3,6,13H2,1H3,(H,21,24)(H2,20,22,28)