Vitas-M small molecule compound
N-(4-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-1,2,3-thiadiazol-5-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL441798
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)c1nnsc1NC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H26ClN7O3S MW 540.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN7O3S/c26-18-3-1-4-19(12-18)30-7-9-31(10-8-30)24(35)22-23(37-29-28-22)27-25(36)32-13-16-11-17(15-32)20-5-2-6-21(34)33(20)14-16/h1-6,12,16-17H,7-11,13-15H2,(H,27,36)InChIKey
YJZMTYUMYJOHCO-UHFFFAOYSA-NSynonyms
C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=C(SN=N3)NC(=O)N4CC5CC(C4)C6=CC=CC(=O)N6C5
InChI=1SC25H26ClN7O3Sc261831419(1218)307931(10830)24(35)2223(37292822)2725(36)3213161117(1532)2052621(34)33(20)1416h16121617H7111315H2(H2736)
MFCD11840409
N(4((4(3chlorophenyl)piperazin1yl)carbonyl)123thiadiazol5yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
ZINC000101377996
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