1-(4-chloranyl-3-nitro-phenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(4-chloro-3-nitro-phenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(4-chloro-3-nitrophenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(4-chloro-3-nitrophenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(4-chloro-3-nitro-phenyl)-3-homoveratryl-thiourea Formula: C17H18ClN3O4S MolecularWeight: 395.86052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C17H18ClN3O4S/c1-24-15-6-3-11(9-16(15)25-2)7-8-19-17(26)20-12-4-5-13(18)14(10-12)21(22)23/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,26)