3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(thiophen-3-ylmethyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-1-methyl-1-(thiophen-3-ylmethyl)thiourea Openeye Name: 3-(2-chloro-5-nitro-phenyl)-1-methyl-1-(3-thienylmethyl)thiourea CAS Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-(3-thiophenylmethyl)thiourea IUPAC Name: 3-(2-chloro-5-nitrophenyl)-1-methyl-1-(thiophen-3-ylmethyl)thiourea Traditional Name: 3-(2-chloro-5-nitro-phenyl)-1-methyl-1-(3-thenyl)thiourea Formula: C13H12ClN3O2S2 MolecularWeight: 341.83628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CC1=CSC=C1)C(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H12ClN3O2S2/c1-16(7-9-4-5-21-8-9)13(20)15-12-6-10(17(18)19)2-3-11(12)14/h2-6,8H,7H2,1H3,(H,15,20)