N-[3-[1-[(4-iodophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[3-[1-[(4-iodophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[3-[2-(4-iodoanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[3-[[1-(4-iodoanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[3-[1-(4-iodoanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[3-[[2-(4-iodoanilino)-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C20H23IN2O2S MolecularWeight: 482.37829

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C20H23IN2O2S/c1-3-4-8-19(24)22-17-6-5-7-18(13-17)26-14(2)20(25)23-16-11-9-15(21)10-12-16/h5-7,9-14H,3-4,8H2,1-2H3,(H,22,24)(H,23,25)