N-(2-iodanylphenyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(2-iodanylphenyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: N-(2-iodophenyl)-4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide CAS Name: N-(2-iodophenyl)-4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(2-iodophenyl)-4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: N-(2-iodophenyl)-4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepane-1-carboxamide Formula: C17H21IN4OS MolecularWeight: 456.34431

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)NC3=CC=CC=C3I

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)NC3=CC=CC=C3I

InChI

InChI=1S/C17H21IN4OS/c1-13-19-14(12-24-13)11-21-7-4-8-22(10-9-21)17(23)20-16-6-3-2-5-15(16)18/h2-3,5-6,12H,4,7-11H2,1H3,(H,20,23)