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

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-methyl-4-nitro-phenyl)carbonylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-methyl-4-nitro-benzoyl)amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-methyl-4-nitrobenzoyl)amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[(3-methyl-4-nitro-benzoyl)amino]thiourea Formula: C14H20N4O4S MolecularWeight: 340.398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NN(C)C(=S)NCCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NN(C)C(=S)NCCCOC)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O4S/c1-10-9-11(5-6-12(10)18(20)21)13(19)16-17(2)14(23)15-7-4-8-22-3/h5-6,9H,4,7-8H2,1-3H3,(H,15,23)(H,16,19)