N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide

Systemtic Name: N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Openeye Name: N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide CAS Name: N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide IUPAC Name: N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Traditional Name: N-(2-methoxyethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Formula: C13H18N2OS2 MolecularWeight: 282.42482

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)N1CCCSC2=CC=CC=C21

Isomeric SMILES

COCCNC(=S)N1CCCSC2=CC=CC=C21

InChI

InChI=1S/C13H18N2OS2/c1-16-9-7-14-13(17)15-8-4-10-18-12-6-3-2-5-11(12)15/h2-3,5-6H,4,7-10H2,1H3,(H,14,17)