3-(4-acetamidophenyl)sulfanyl-N-phenylmethoxy-heptanamide

Systemtic Name: 3-(4-acetamidophenyl)sulfanyl-N-phenylmethoxy-heptanamide Openeye Name: 3-(4-acetamidophenyl)sulfanyl-N-benzyloxy-heptanamide CAS Name: 3-[(4-acetamidophenyl)thio]-N-phenylmethoxyheptanamide IUPAC Name: 3-(4-acetamidophenyl)sulfanyl-N-phenylmethoxyheptanamide Traditional Name: 3-[(4-acetamidophenyl)thio]-N-benzoxy-enanthamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)NOCC1=CC=CC=C1)SC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCCC(CC(=O)NOCC1=CC=CC=C1)SC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C22H28N2O3S/c1-3-4-10-21(28-20-13-11-19(12-14-20)23-17(2)25)15-22(26)24-27-16-18-8-6-5-7-9-18/h5-9,11-14,21H,3-4,10,15-16H2,1-2H3,(H,23,25)(H,24,26)