5-(2-methylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one

Systemtic Name: 5-(2-methylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one Openeye Name: 5-(o-tolyl)-1,5-dihydro-4,1-benzothiazepin-2-one CAS Name: 5-(2-methylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one IUPAC Name: 5-(2-methylphenyl)-1,5-dihydro-4,1-benzothiazepin-2-one Traditional Name: 5-(o-tolyl)-1,5-dihydro-4,1-benzothiazepin-2-one Formula: C16H15NOS MolecularWeight: 269.3614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3=CC=CC=C3NC(=O)CS2

Isomeric SMILES

CC1=CC=CC=C1C2C3=CC=CC=C3NC(=O)CS2

InChI

InChI=1S/C16H15NOS/c1-11-6-2-3-7-12(11)16-13-8-4-5-9-14(13)17-15(18)10-19-16/h2-9,16H,10H2,1H3,(H,17,18)