3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-N-phenyl-1,3-thiazol-2-imine

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-N-phenyl-1,3-thiazol-2-imine Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-N-phenyl-thiazol-2-imine CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-N-phenyl-2-thiazolimine IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-nitrophenyl)-N-phenyl-1,3-thiazol-2-imine Traditional Name: [3-homoveratryl-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=CSC2=NC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=CSC2=NC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H23N3O4S/c1-31-23-12-11-18(15-24(23)32-2)13-14-27-22(19-7-6-10-21(16-19)28(29)30)17-33-25(27)26-20-8-4-3-5-9-20/h3-12,15-17H,13-14H2,1-2H3