N-(3-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: N-(3-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: N-(3-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: N-(3-chlorophenyl)-3-[3-(1-imidazolyl)propyl]-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: N-(3-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: (3-chlorophenyl)-[3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]amine Formula: C21H18ClN5O2S MolecularWeight: 439.91792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=NC3=CC(=CC=C3)Cl)N2CCCN4C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=NC3=CC(=CC=C3)Cl)N2CCCN4C=CN=C4

InChI

InChI=1S/C21H18ClN5O2S/c22-17-5-2-6-18(13-17)24-21-26(10-3-9-25-11-8-23-15-25)20(14-30-21)16-4-1-7-19(12-16)27(28)29/h1-2,4-8,11-15H,3,9-10H2