3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-methyl-1-(2-morpholino-2-oxo-ethyl)thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-[2-(4-morpholinyl)-2-oxoethyl]thiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-(2-morpholin-4-yl-2-oxoethyl)thiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-(2-keto-2-morpholino-ethyl)-1-methyl-thiourea Formula: C14H17ClN4O4S MolecularWeight: 372.82718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCOCC1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CC(=O)N1CCOCC1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H17ClN4O4S/c1-17(9-13(20)18-4-6-23-7-5-18)14(24)16-12-8-10(19(21)22)2-3-11(12)15/h2-3,8H,4-7,9H2,1H3,(H,16,24)