1-(2-methoxy-4-nitro-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea

Systemtic Name: 1-(2-methoxy-4-nitro-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea Openeye Name: 1-(2-methoxy-4-nitro-phenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea CAS Name: 1-(2-methoxy-4-nitrophenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea IUPAC Name: 1-(2-methoxy-4-nitrophenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea Traditional Name: 1-[3-(2-ketopyrrolidino)propyl]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCCCN2CCCC2=O

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NCCCN2CCCC2=O

InChI

InChI=1S/C15H20N4O4S/c1-23-13-10-11(19(21)22)5-6-12(13)17-15(24)16-7-3-9-18-8-2-4-14(18)20/h5-6,10H,2-4,7-9H2,1H3,(H2,16,17,24)