2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-3-methyl-quinoxaline

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-3-methyl-quinoxaline Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-3-methyl-quinoxaline CAS Name: 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]-3-methylquinoxaline IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanylmethyl)-3-methylquinoxaline Traditional Name: 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)methyl]-3-methyl-quinoxaline Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H18N2O2S/c1-13-17(21-16-6-3-2-5-15(16)20-13)12-24-14-7-8-18-19(11-14)23-10-4-9-22-18/h2-3,5-8,11H,4,9-10,12H2,1H3