3-(3-methoxypropyl)-1-methyl-1-[(4-nitrophenyl)carbonylamino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[(4-nitrophenyl)carbonylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[(4-nitrobenzoyl)amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[(4-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[(4-nitrobenzoyl)amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[(4-nitrobenzoyl)amino]thiourea Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C13H18N4O4S/c1-16(13(22)14-8-3-9-21-2)15-12(18)10-4-6-11(7-5-10)17(19)20/h4-7H,3,8-9H2,1-2H3,(H,14,22)(H,15,18)