4-[4-(azepan-1-ylsulfonyl)phenyl]-3-cyclohexyl-N-phenyl-1,3-thiazol-2-imine

Systemtic Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-cyclohexyl-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-cyclohexyl-N-phenyl-thiazol-2-imine CAS Name: 4-[4-(1-azepanylsulfonyl)phenyl]-3-cyclohexyl-N-phenyl-2-thiazolimine IUPAC Name: 4-[4-(azepan-1-ylsulfonyl)phenyl]-3-cyclohexyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(azepan-1-ylsulfonyl)phenyl]-3-cyclohexyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C27H33N3O2S2 MolecularWeight: 495.69982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3C5CCCCC5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3C5CCCCC5

InChI

InChI=1S/C27H33N3O2S2/c31-34(32,29-19-9-1-2-10-20-29)25-17-15-22(16-18-25)26-21-33-27(28-23-11-5-3-6-12-23)30(26)24-13-7-4-8-14-24/h3,5-6,11-12,15-18,21,24H,1-2,4,7-10,13-14,19-20H2