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

Systemtic Name: N-(2-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: N-(2-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: N-(2-chlorophenyl)-3-[3-(1-imidazolyl)propyl]-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: N-(2-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: (2-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=C(C(=C1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])CCCN4C=CN=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N=C2N(C(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])CCCN4C=CN=C4)Cl

InChI

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