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

Systemtic Name: 1-(3-methoxypropyl)-3-[2-(4-nitrophenyl)ethanoylamino]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea CAS Name: 1-(3-methoxypropyl)-3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[[2-(4-nitrophenyl)acetyl]amino]thiourea Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NNC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=S)NNC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O4S/c1-21-8-2-7-14-13(22)16-15-12(18)9-10-3-5-11(6-4-10)17(19)20/h3-6H,2,7-9H2,1H3,(H,15,18)(H2,14,16,22)