CAS: 112966-96-8 - Domitroban

Formula: C₂₀H₂₇NO₄S

InChI: InChI=1S/C20H27NO4S/c22-19(23)11-7-2-1-6-10-18-15-12-13-16(14-15)20(18)21-26(24,25)17-8-4-3-5-9-17/h1,3-6,8-9,15-16,18,20-21H,2,7,10-14H2,(H,22,23)/b6-1-/t15-,16+,18+,20+/m1/s1

InChI key: InChIKey=PWTCIBWRMQFJBC-ZEMKZVSASA-N

SMILES: O=C(O)CCCC=CCC1C2CCC(C2)C1NS(=O)(=O)C=3C=CC=CC3

Synonyms:

• Domitroban
• 5-Heptenoic acid, 7-[3-[(phenylsulfonyl)amino]bicyclo[2.2.1]hept-2-yl]-, [1R-[1α,2α(Z),3β,4α]]-
• 5-Heptenoic acid, 7-[(1R,2S,3S,4S)-3-[(phenylsulfonyl)amino]bicyclo[2.2.1]hept-2-yl]-, (5Z)-
• (+)-S 145
• (5Z)-7-[(1R,2S,3S,4S)-3-[(Phenylsulfonyl)amino]bicyclo[2.2.1]hept-2-yl]-5-heptenoic acid

Domitroban

CAS: 112966-96-8

Domitroban, also known as S-145, is a thromboxane (Tx) A2-receptor antagonist with partial agonistic activity …

• Formula: C₂₀H₂₇NO₄S
• Color and Shape: Solid
• Molecular weight: 377.5