1-[2-(cyclohexen-1-yl)-4-iodanyl-phenyl]sulfonyl-3-pentyl-urea

Systemtic Name: 1-[2-(cyclohexen-1-yl)-4-iodanyl-phenyl]sulfonyl-3-pentyl-urea Openeye Name: 1-[2-(cyclohexen-1-yl)-4-iodo-phenyl]sulfonyl-3-pentyl-urea CAS Name: 1-[2-(1-cyclohexenyl)-4-iodophenyl]sulfonyl-3-pentylurea IUPAC Name: 1-[2-(cyclohexen-1-yl)-4-iodophenyl]sulfonyl-3-pentylurea Traditional Name: 1-amyl-3-[2-(cyclohexen-1-yl)-4-iodo-phenyl]sulfonyl-urea Formula: C18H25IN2O3S MolecularWeight: 476.37217

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NS(=O)(=O)C1=C(C=C(C=C1)I)C2=CCCCC2

Isomeric SMILES

CCCCCNC(=O)NS(=O)(=O)C1=C(C=C(C=C1)I)C2=CCCCC2

InChI

InChI=1S/C18H25IN2O3S/c1-2-3-7-12-20-18(22)21-25(23,24)17-11-10-15(19)13-16(17)14-8-5-4-6-9-14/h8,10-11,13H,2-7,9,12H2,1H3,(H2,20,21,22)