N-[2-hydroxyethyl-(phenylmethyl)carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[2-hydroxyethyl-(phenylmethyl)carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[benzyl(2-hydroxyethyl)carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[2-hydroxyethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[benzyl(2-hydroxyethyl)carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[benzyl(2-hydroxyethyl)thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C18H19IN2O2S MolecularWeight: 454.32513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)N(CCO)CC2=CC=CC=C2)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)N(CCO)CC2=CC=CC=C2)I

InChI

InChI=1S/C18H19IN2O2S/c1-13-7-8-15(11-16(13)19)17(23)20-18(24)21(9-10-22)12-14-5-3-2-4-6-14/h2-8,11,22H,9-10,12H2,1H3,(H,20,23,24)