1-[(Z)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[(Z)-(4-chloranyl-3-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[(Z)-(4-chloro-3-nitro-phenyl)methyleneamino]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-[(Z)-(4-chloro-3-nitro-benzylidene)amino]-3-(3,4-dimethoxyphenyl)thiourea Formula: C16H15ClN4O4S MolecularWeight: 394.8327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NN=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)N/N=C\C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C16H15ClN4O4S/c1-24-14-6-4-11(8-15(14)25-2)19-16(26)20-18-9-10-3-5-12(17)13(7-10)21(22)23/h3-9H,1-2H3,(H2,19,20,26)/b18-9-