6-[2-phenylimino-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-yl]hexan-1-ol

Systemtic Name: 6-[2-phenylimino-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-yl]hexan-1-ol Openeye Name: 6-[2-phenylimino-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-3-yl]hexan-1-ol CAS Name: 6-[2-phenylimino-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-3-thiazolyl]-1-hexanol IUPAC Name: 6-[2-phenylimino-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-yl]hexan-1-ol Traditional Name: 6-[2-phenylimino-4-(4-pyrrolidinosulfonylphenyl)-4-thiazolin-3-yl]hexan-1-ol Formula: C25H31N3O3S2 MolecularWeight: 485.66194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CCCCCCO

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CCCCCCO

InChI

InChI=1S/C25H31N3O3S2/c29-19-9-2-1-6-18-28-24(20-32-25(28)26-22-10-4-3-5-11-22)21-12-14-23(15-13-21)33(30,31)27-16-7-8-17-27/h3-5,10-15,20,29H,1-2,6-9,16-19H2