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

Systemtic Name: N-cyclopropyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Openeye Name: N-cyclopropyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide CAS Name: N-cyclopropyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide IUPAC Name: N-cyclopropyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Traditional Name: N-cyclopropyl-3,4-dihydro-2H-1,5-benzothiazepine-5-carbothioamide Formula: C13H16N2S2 MolecularWeight: 264.40954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=S)NC3CC3

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=S)NC3CC3

InChI

InChI=1S/C13H16N2S2/c16-13(14-10-6-7-10)15-8-3-9-17-12-5-2-1-4-11(12)15/h1-2,4-5,10H,3,6-9H2,(H,14,16)