3-azanyl-4,5-dihydro-3H-1,5-benzothiazepin-2-one

Systemtic Name: 3-azanyl-4,5-dihydro-3H-1,5-benzothiazepin-2-one Openeye Name: 3-amino-4,5-dihydro-3H-1,5-benzothiazepin-2-one CAS Name: 3-amino-4,5-dihydro-3H-1,5-benzothiazepin-2-one IUPAC Name: 3-amino-4,5-dihydro-3H-1,5-benzothiazepin-2-one Traditional Name: 3-amino-4,5-dihydro-3H-1,5-benzothiazepin-2-one Formula: C9H10N2OS MolecularWeight: 194.2535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)SC2=CC=CC=C2N1)N

Isomeric SMILES

C1C(C(=O)SC2=CC=CC=C2N1)N

InChI

InChI=1S/C9H10N2OS/c10-6-5-11-7-3-1-2-4-8(7)13-9(6)12/h1-4,6,11H,5,10H2