3-iodanyl-4-methoxy-N-pyrrolidin-1-ylcarbothioyl-benzamide

Systemtic Name: 3-iodanyl-4-methoxy-N-pyrrolidin-1-ylcarbothioyl-benzamide Openeye Name: 3-iodo-4-methoxy-N-(pyrrolidine-1-carbothioyl)benzamide CAS Name: 3-iodo-4-methoxy-N-[1-pyrrolidinyl(sulfanylidene)methyl]benzamide IUPAC Name: 3-iodo-4-methoxy-N-(pyrrolidine-1-carbothioyl)benzamide Traditional Name: 3-iodo-4-methoxy-N-(pyrrolidine-1-carbothioyl)benzamide Formula: C13H15IN2O2S MolecularWeight: 390.23987

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCC2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCC2)I

InChI

InChI=1S/C13H15IN2O2S/c1-18-11-5-4-9(8-10(11)14)12(17)15-13(19)16-6-2-3-7-16/h4-5,8H,2-3,6-7H2,1H3,(H,15,17,19)