N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]pentanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]pentanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]pentanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]pentanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]pentanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]valeramide Formula: C18H17IN2OS MolecularWeight: 436.30985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)I)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)I)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17IN2OS/c1-2-3-8-17(22)20-14-10-9-12(19)11-13(14)18-21-15-6-4-5-7-16(15)23-18/h4-7,9-11H,2-3,8H2,1H3,(H,20,22)