1-(2-chloranyl-5-nitro-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(2-oxo-1-pyrrolidinyl)propyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-[3-(2-ketopyrrolidino)propyl]thiourea Formula: C14H17ClN4O3S MolecularWeight: 356.82778

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H17ClN4O3S/c15-11-5-4-10(19(21)22)9-12(11)17-14(23)16-6-2-8-18-7-1-3-13(18)20/h4-5,9H,1-3,6-8H2,(H2,16,17,23)