3-azanyl-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one

Systemtic Name: 3-azanyl-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Openeye Name: 3-amino-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one CAS Name: 3-amino-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-propanone IUPAC Name: 3-amino-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Traditional Name: 3-amino-1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Formula: C12H16N2OS MolecularWeight: 236.33324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)CCN

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)CCN

InChI

InChI=1S/C12H16N2OS/c13-7-6-12(15)14-8-3-9-16-11-5-2-1-4-10(11)14/h1-2,4-5H,3,6-9,13H2