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

Systemtic Name: 1-[(Z)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[(Z)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[(Z)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[(Z)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-[(Z)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-(3,4-dimethoxyphenyl)thiourea Formula: C17H17ClN4O4S MolecularWeight: 408.85928

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC(=C(C=C1)OC)OC)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NC1=CC(=C(C=C1)OC)OC)/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN4O4S/c1-10(11-4-6-13(18)14(8-11)22(23)24)20-21-17(27)19-12-5-7-15(25-2)16(9-12)26-3/h4-9H,1-3H3,(H2,19,21,27)/b20-10-