10-bromanyl-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine

Systemtic Name: 10-bromanyl-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Openeye Name: 10-bromo-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine CAS Name: 10-bromo-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-[1]benzopyrano[3,4-c][1,5]benzothiazepine IUPAC Name: 10-bromo-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Traditional Name: 10-bromo-6,7-bis(4-methoxyphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Formula: C30H24BrNO3S MolecularWeight: 558.48546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3C(SC4=C(C=CC(=C4)Br)N=C3C5=CC=CC=C5O2)C6=CC=C(C=C6)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2C3C(SC4=C(C=CC(=C4)Br)N=C3C5=CC=CC=C5O2)C6=CC=C(C=C6)OC

InChI

InChI=1S/C30H24BrNO3S/c1-33-21-12-7-18(8-13-21)29-27-28(23-5-3-4-6-25(23)35-29)32-24-16-11-20(31)17-26(24)36-30(27)19-9-14-22(34-2)15-10-19/h3-17,27,29-30H,1-2H3