| SpectraBase Spectrum ID |
5jbe0MopsVC |
| Name |
(4S)-7-[3'-Butenyl(phenylsulfonyl)amino]-6-iodo-4-(hydroxy)-8-methoxy-1-(phenylsulfonyl)-2,3,4,5-tetrahydrobenzazepine |
| Alternate Name(s) |
7-[3'-Butenyl(phenylsulfonyl)amino]-6-iodo-4-(hydroxymethyl)-8-methoxy-1-(phenylsulfonyl)-2,3,4,5-tetrahydrobenzazepine
N-(3-butenyl)-N-[(4S)-4-hydroxy-6-iodo-8-methoxy-1-(phenylsulfonyl)-2,3,4,5-tetrahydro-1H-1-benzazepin-7-yl]benzenesulfonamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H29IN2O6S2 |
| InChI |
InChI=1S/C27H29IN2O6S2/c1-3-4-16-30(38(34,35)22-13-9-6-10-14-22)27-25(36-2)19-24-23(26(27)28)18-20(31)15-17-29(24)37(32,33)21-11-7-5-8-12-21/h3,5-14,19-20,31H,1,4,15-18H2,2H3/t20-/m1/s1 |
| InChIKey |
ODTKICWFPPDHRG-HXUWFJFHSA-N |
| Molecular Weight |
668.561 g/mol |
| SMILES |
O[C@@]1(CCN(S(=O)(=O)c2ccccc2)c2c(c(I)c(c(c2)OC)N(S(=O)(=O)c2ccccc2)CCC=C)C1)[H] |
| SPLASH |
splash10-00or-9000071000-6e660fc081929d117a63 |
| Source of Spectrum |
K1-43523-2754-18 |
| Wiley ID |
1521252 |
![(4S)-7-[3'-Butenyl(phenylsulfonyl)amino]-6-iodo-4-(hydroxy)-8-methoxy-1-(phenylsulfonyl)-2,3,4,5-tetrahydrobenzazepine](/api/spectrum/5jbe0MopsVC/structure.png?h=300&w=458 "(4S)-7-[3'-Butenyl(phenylsulfonyl)amino]-6-iodo-4-(hydroxy)-8-methoxy-1-(phenylsulfonyl)-2,3,4,5-tetrahydrobenzazepine")
