N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide

Systemtic Name: N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Openeye Name: N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide CAS Name: N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide IUPAC Name: N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Traditional Name: N-methyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Formula: C11H14N2S2 MolecularWeight: 238.37226

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCCSC2=CC=CC=C21

Isomeric SMILES

CNC(=S)N1CCCSC2=CC=CC=C21

InChI

InChI=1S/C11H14N2S2/c1-12-11(14)13-7-4-8-15-10-6-3-2-5-9(10)13/h2-3,5-6H,4,7-8H2,1H3,(H,12,14)