2-iodanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzamide

Systemtic Name: 2-iodanyl-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzamide Openeye Name: 2-iodo-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzamide CAS Name: 2-iodo-N-[5-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: 2-iodo-N-[5-methoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]benzamide Traditional Name: 2-iodo-N-[5-methoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzamide Formula: C18H17IN2O2S2 MolecularWeight: 484.37425

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=NC(=O)C3=CC=CC=C3I)N2CCSC

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=NC(=O)C3=CC=CC=C3I)N2CCSC

InChI

InChI=1S/C18H17IN2O2S2/c1-23-12-7-8-16-15(11-12)21(9-10-24-2)18(25-16)20-17(22)13-5-3-4-6-14(13)19/h3-8,11H,9-10H2,1-2H3