1-[(Z)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[(Z)-(2-chloranyl-5-nitro-phenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[(Z)-(2-chloro-5-nitro-phenyl)methyleneamino]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[(Z)-(2-chloro-5-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[(Z)-(2-chloro-5-nitrophenyl)methylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-[(Z)-(2-chloro-5-nitro-benzylidene)amino]-3-(3,4-dimethoxyphenyl)thiourea Formula: C16H15ClN4O4S MolecularWeight: 394.8327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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