1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitro-phenyl)thiourea

Systemtic Name: 1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitro-phenyl)thiourea Openeye Name: 1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitro-phenyl)thiourea CAS Name: 1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitrophenyl)thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitrophenyl)thiourea Traditional Name: 1-(2-dimethylaminoethyl)-3-(2-methoxy-5-nitro-phenyl)thiourea Formula: C12H18N4O3S MolecularWeight: 298.36132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CN(C)CCNC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C12H18N4O3S/c1-15(2)7-6-13-12(20)14-10-8-9(16(17)18)4-5-11(10)19-3/h4-5,8H,6-7H2,1-3H3,(H2,13,14,20)