N-(3-iodanyl-4-methyl-phenyl)-2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-2-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-1-yl]acetamide CAS Name: N-(3-iodo-4-methylphenyl)-2-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-iodo-4-methylphenyl)-2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-2-[4-[(5-methylisoxazol-3-yl)methyl]piperazino]acetamide Formula: C18H23IN4O2 MolecularWeight: 454.30529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=NOC(=C3)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)CC3=NOC(=C3)C)I

InChI

InChI=1S/C18H23IN4O2/c1-13-3-4-15(10-17(13)19)20-18(24)12-23-7-5-22(6-8-23)11-16-9-14(2)25-21-16/h3-4,9-10H,5-8,11-12H2,1-2H3,(H,20,24)