4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine CAS Name: 4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 4-(1,3-benzodioxol-4-yl)-2-methyl-2,3-dihydro-1,5-benzothiazepine Formula: C17H15NO2S MolecularWeight: 297.3715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NC2=CC=CC=C2S1)C3=C4C(=CC=C3)OCO4

Isomeric SMILES

CC1CC(=NC2=CC=CC=C2S1)C3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C17H15NO2S/c1-11-9-14(18-13-6-2-3-8-16(13)21-11)12-5-4-7-15-17(12)20-10-19-15/h2-8,11H,9-10H2,1H3