2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione CAS Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-phenyl-5,7-dihydropyrido[3,2-d][1]benzazepine-6-thione Formula: C26H18N2O2S MolecularWeight: 422.49832

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3NC1=S)N=C(C=C2C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C2=C(C3=CC=CC=C3NC1=S)N=C(C=C2C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H18N2O2S/c31-25-14-20-19(16-6-2-1-3-7-16)13-22(17-10-11-23-24(12-17)30-15-29-23)28-26(20)18-8-4-5-9-21(18)27-25/h1-13H,14-15H2,(H,27,31)