CAS Registry Number®
199191-67-8
CAS Name
2-[[Methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]benzoic acid
Molecular Formula
C26H23NO4S
Molecular Mass
445.53
Other Names and Identifiers
InChI
InChI=1S/C26H23NO4S/c1-27(25(28)20-11-4-5-12-21(20)26(29)30)16-15-23(24-14-7-17-32-24)31-22-13-6-9-18-8-2-3-10-19(18)22/h2-14,17,23H,15-16H2,1H3,(H,29,30)/t23-/m0/s1
InChIKey
InChIKey=QYWSULHSCQVWPV-QHCPKHFHSA-N
SMILES
O([C@@H](CCN(C(=O)C1=C(C(O)=O)C=CC=C1)C)C2=CC=CS2)C=3C4=C(C=CC3)C=CC=C4
Canonical SMILES
O=C(O)C=1C=CC=CC1C(=O)N(C)CCC(OC2=CC=CC=3C=CC=CC23)C=4SC=CC4
Other Names for this Substance
- Benzoic acid, 2-[[methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]-
- 2-[[Methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]benzoic acid
