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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine CAS Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine Formula: C22H17NO2S MolecularWeight: 359.44088

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17NO2S/c1-2-6-15(7-3-1)18-13-22(26-21-9-5-4-8-17(21)23-18)16-10-11-19-20(12-16)25-14-24-19/h1-12,22H,13-14H2