7-(1,3-benzothiazol-2-yl)-9-methoxy-4-[(2-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-[(2-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-[(2-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-[(2-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-[(2-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(1,3-benzothiazol-2-yl)-9-methoxy-4-o-anisyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=CC=C1CN2CCOC3=C(C2)C=C(C=C3OC)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H24N2O3S/c1-28-21-9-5-3-7-17(21)15-27-11-12-30-24-19(16-27)13-18(14-22(24)29-2)25-26-20-8-4-6-10-23(20)31-25/h3-10,13-14H,11-12,15-16H2,1-2H3