1-dodecyl-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-dodecyl-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-dodecyl-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-dodecyl-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-dodecyl-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-lauryl-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C20H33N3O3S MolecularWeight: 395.55932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

Isomeric SMILES

CCCCCCCCCCCCNC(=S)NC1=C(C=C(C=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C20H33N3O3S/c1-3-4-5-6-7-8-9-10-11-12-15-21-20(27)22-18-14-13-17(23(24)25)16-19(18)26-2/h13-14,16H,3-12,15H2,1-2H3,(H2,21,22,27)