3-iodanyl-5-methyl-2-pentyl-1,5-benzothiazepin-4-one

Systemtic Name: 3-iodanyl-5-methyl-2-pentyl-1,5-benzothiazepin-4-one Openeye Name: 3-iodo-5-methyl-2-pentyl-1,5-benzothiazepin-4-one CAS Name: 3-iodo-5-methyl-2-pentyl-1,5-benzothiazepin-4-one IUPAC Name: 3-iodo-5-methyl-2-pentyl-1,5-benzothiazepin-4-one Traditional Name: 2-amyl-3-iodo-5-methyl-1,5-benzothiazepin-4-one Formula: C15H18INOS MolecularWeight: 387.27899

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)N(C2=CC=CC=C2S1)C)I

Isomeric SMILES

CCCCCC1=C(C(=O)N(C2=CC=CC=C2S1)C)I

InChI

InChI=1S/C15H18INOS/c1-3-4-5-10-13-14(16)15(18)17(2)11-8-6-7-9-12(11)19-13/h6-9H,3-5,10H2,1-2H3