N-(2-ethyl-3-iodanyl-phenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide

Systemtic Name: N-(2-ethyl-3-iodanyl-phenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide Openeye Name: N-(2-ethyl-3-iodo-phenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide CAS Name: N-(2-ethyl-3-iodophenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide IUPAC Name: N-(2-ethyl-3-iodophenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide Traditional Name: N-(2-ethyl-3-iodo-phenyl)-2-(2-phenyldecyl)-1,3-thiazinane-3-carbothioamide Formula: C29H41IN2S2 MolecularWeight: 608.68371

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC1N(CCCS1)C(=S)NC2=C(C(=CC=C2)I)CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCC(CC1N(CCCS1)C(=S)NC2=C(C(=CC=C2)I)CC)C3=CC=CC=C3

InChI

InChI=1S/C29H41IN2S2/c1-3-5-6-7-8-10-17-24(23-15-11-9-12-16-23)22-28-32(20-14-21-34-28)29(33)31-27-19-13-18-26(30)25(27)4-2/h9,11-13,15-16,18-19,24,28H,3-8,10,14,17,20-22H2,1-2H3,(H,31,33)