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

Systemtic Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-butyl-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-butyl-N-phenyl-thiazol-2-imine CAS Name: 4-[3-(1-azepanylsulfonyl)phenyl]-3-butyl-N-phenyl-2-thiazolimine IUPAC Name: 4-[3-(azepan-1-ylsulfonyl)phenyl]-3-butyl-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[3-(azepan-1-ylsulfonyl)phenyl]-3-butyl-4-thiazolin-2-ylidene]-phenyl-amine Formula: C25H31N3O2S2 MolecularWeight: 469.66254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O2S2/c1-2-3-18-28-24(20-31-25(28)26-22-13-7-6-8-14-22)21-12-11-15-23(19-21)32(29,30)27-16-9-4-5-10-17-27/h6-8,11-15,19-20H,2-5,9-10,16-18H2,1H3