9-methoxy-4-[[5-(methoxymethyl)furan-2-yl]methyl]-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 9-methoxy-4-[[5-(methoxymethyl)furan-2-yl]methyl]-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 9-methoxy-4-[[5-(methoxymethyl)-2-furyl]methyl]-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 9-methoxy-4-[[5-(methoxymethyl)-2-furanyl]methyl]-7-[4-(methylthio)phenyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 9-methoxy-4-[[5-(methoxymethyl)furan-2-yl]methyl]-7-(4-methylsulfanylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 9-methoxy-4-[[5-(methoxymethyl)-2-furyl]methyl]-7-[4-(methylthio)phenyl]-3,5-dihydro-2H-1,4-benzoxazepine Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(O1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=CC=C(C=C4)SC

Isomeric SMILES

COCC1=CC=C(O1)CN2CCOC3=C(C2)C=C(C=C3OC)C4=CC=C(C=C4)SC

InChI

InChI=1S/C24H27NO4S/c1-26-16-21-7-6-20(29-21)15-25-10-11-28-24-19(14-25)12-18(13-23(24)27-2)17-4-8-22(30-3)9-5-17/h4-9,12-13H,10-11,14-16H2,1-3H3