2-azanyl-1-[3-[2-(9H-carbazol-2-yloxy)ethyl]-5-methylsulfonyl-2-(phenylmethyl)-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol

Systemtic Name: 2-azanyl-1-[3-[2-(9H-carbazol-2-yloxy)ethyl]-5-methylsulfonyl-2-(phenylmethyl)-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol Openeye Name: 2-amino-1-[2-benzyl-3-[2-(9H-carbazol-2-yloxy)ethyl]-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol CAS Name: 2-amino-1-[3-[2-(9H-carbazol-2-yloxy)ethyl]-5-methylsulfonyl-2-(phenylmethyl)-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol IUPAC Name: 2-amino-1-[2-benzyl-3-[2-(9H-carbazol-2-yloxy)ethyl]-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol Traditional Name: 2-amino-1-[2-benzyl-3-[2-(9H-carbazol-2-yloxy)ethyl]-5-mesyl-3,4-dihydro-2H-1,5-benzoxazepin-4-yl]ethanol Formula: C33H35N3O5S MolecularWeight: 585.7131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(C(C(OC2=CC=CC=C21)CC3=CC=CC=C3)CCOC4=CC5=C(C=C4)C6=CC=CC=C6N5)C(CN)O

Isomeric SMILES

CS(=O)(=O)N1C(C(C(OC2=CC=CC=C21)CC3=CC=CC=C3)CCOC4=CC5=C(C=C4)C6=CC=CC=C6N5)C(CN)O

InChI

InChI=1S/C33H35N3O5S/c1-42(38,39)36-29-13-7-8-14-31(29)41-32(19-22-9-3-2-4-10-22)26(33(36)30(37)21-34)17-18-40-23-15-16-25-24-11-5-6-12-27(24)35-28(25)20-23/h2-16,20,26,30,32-33,35,37H,17-19,21,34H2,1H3