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

Systemtic Name: N-(4-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: N-(4-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: N-(4-chlorophenyl)-3-[3-(1-imidazolyl)propyl]-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: N-(4-chlorophenyl)-3-(3-imidazol-1-ylpropyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: (4-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=C(C=C3)Cl)N2CCCN4C=CN=C4

Isomeric SMILES

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

InChI

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