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

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[2-(4-nitrophenyl)sulfanylethanoylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-[[2-[(4-nitrophenyl)thio]acetyl]amino]thiourea Formula: C14H20N4O4S2 MolecularWeight: 372.463

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)CSC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H20N4O4S2/c1-17(14(23)15-8-3-9-22-2)16-13(19)10-24-12-6-4-11(5-7-12)18(20)21/h4-7H,3,8-10H2,1-2H3,(H,15,23)(H,16,19)