7-(1,3-benzothiazol-2-yl)-4-(furan-2-ylmethyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-(furan-2-ylmethyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-(2-furylmethyl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(1,3-benzothiazol-2-yl)-4-(2-furanylmethyl)-9-(3-oxolanyloxy)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-(furan-2-ylmethyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-(2-furfuryl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1OC2=CC(=CC3=C2OCCN(C3)CC4=CC=CO4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1COCC1OC2=CC(=CC3=C2OCCN(C3)CC4=CC=CO4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H24N2O4S/c1-2-6-23-21(5-1)26-25(32-23)17-12-18-14-27(15-19-4-3-9-29-19)8-11-30-24(18)22(13-17)31-20-7-10-28-16-20/h1-6,9,12-13,20H,7-8,10-11,14-16H2