3-iodanyl-4-methoxy-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]benzamide Openeye Name: 3-iodo-4-methoxy-N-[propyl(tetrahydrofuran-2-ylmethyl)carbamothioyl]benzamide CAS Name: 3-iodo-4-methoxy-N-[[2-oxolanylmethyl(propyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]benzamide Traditional Name: 3-iodo-4-methoxy-N-[propyl(tetrahydrofurfuryl)thiocarbamoyl]benzamide Formula: C17H23IN2O3S MolecularWeight: 462.34559

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCCO1)C(=S)NC(=O)C2=CC(=C(C=C2)OC)I

Isomeric SMILES

CCCN(CC1CCCO1)C(=S)NC(=O)C2=CC(=C(C=C2)OC)I

InChI

InChI=1S/C17H23IN2O3S/c1-3-8-20(11-13-5-4-9-23-13)17(24)19-16(21)12-6-7-15(22-2)14(18)10-12/h6-7,10,13H,3-5,8-9,11H2,1-2H3,(H,19,21,24)