2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-8-methyl-imidazo[1,2-a]pyridine

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-8-methyl-imidazo[1,2-a]pyridine Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-8-methyl-imidazo[1,2-a]pyridine CAS Name: 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]-8-methylimidazo[1,2-a]pyridine IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-8-methylimidazo[1,2-a]pyridine Traditional Name: 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]-8-methyl-imidazo[1,2-a]pyridine Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2)CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2)CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H18N2O2S/c1-13-4-2-7-20-11-14(19-18(13)20)12-23-15-5-6-16-17(10-15)22-9-3-8-21-16/h2,4-7,10-11H,3,8-9,12H2,1H3