4-heptoxy-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-heptoxy-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-heptoxy-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-yl]benzamide CAS Name: 4-heptoxy-N-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]benzamide IUPAC Name: 4-heptoxy-N-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-heptoxy-N-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]benzamide Formula: C27H33N3O4S2 MolecularWeight: 527.69862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C27H33N3O4S2/c1-2-3-4-5-8-19-34-23-13-9-22(10-14-23)26(31)29-27-28-25(20-35-27)21-11-15-24(16-12-21)36(32,33)30-17-6-7-18-30/h9-16,20H,2-8,17-19H2,1H3,(H,28,29,31)