7-[ethoxy(phenyl)methyl]-4-(thian-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-[ethoxy(phenyl)methyl]-4-(thian-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-[ethoxy(phenyl)methyl]-4-tetrahydrothiopyran-4-yl-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-[ethoxy(phenyl)methyl]-4-(4-thianyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-[ethoxy(phenyl)methyl]-4-(thian-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-[ethoxy(phenyl)methyl]-4-tetrahydrothiopyran-4-yl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C23H29NO2S MolecularWeight: 383.54686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=CC=C1)C2=CC3=C(C=C2)OCCN(C3)C4CCSCC4

Isomeric SMILES

CCOC(C1=CC=CC=C1)C2=CC3=C(C=C2)OCCN(C3)C4CCSCC4

InChI

InChI=1S/C23H29NO2S/c1-2-25-23(18-6-4-3-5-7-18)19-8-9-22-20(16-19)17-24(12-13-26-22)21-10-14-27-15-11-21/h3-9,16,21,23H,2,10-15,17H2,1H3