2-[[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]methyl]-1,3-benzothiazole

Systemtic Name: 2-[[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]methyl]-1,3-benzothiazole Openeye Name: 2-[[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]methyl]-1,3-benzothiazole CAS Name: 2-[[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]methyl]-1,3-benzothiazole IUPAC Name: 2-[[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]methyl]-1,3-benzothiazole Traditional Name: 2-[[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]methyl]-1,3-benzothiazole Formula: C18H17NO2S3 MolecularWeight: 375.52808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H17NO2S3/c1-20-15-10-12(18-22-8-9-23-18)6-7-14(15)21-11-17-19-13-4-2-3-5-16(13)24-17/h2-7,10,18H,8-9,11H2,1H3