Vitas-M small molecule compound
(1S,5R)-N-(2-bromo-4-methylphenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Catalog ID
STK686119
SMILES Cc1ccc(c(c1)Br)NC(=S)N1C[C@H]2C[C@@H](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 C19H20BrN3OS MW 418.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrN3OS/c1-12-5-6-16(15(20)7-12)21-19(25)22-9-13-8-14(11-22)17-3-2-4-18(24)23(17)10-13/h2-7,13-14H,8-11H2,1H3,(H,21,25)/t13-,14+/m0/s1InChIKey
CVOPZPPLAQLZKP-UONOGXRCSA-NSynonyms
1087708-87-9(1R5R)N(2bromo4methylphenyl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carbothioamide
(1S5R)N(2bromo4methylphenyl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carbothioamide
CC1=CC(=C(C=C1)NC(=S)N2CC3CC(C2)C4=CC=CC(=O)N4C3)Br
Cc1ccc(c(c1)Br)NC(=S)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
Cc1ccc(c(c1)Br)NC(=S)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
Registry IDs
MFCD03662264ZINC000002146083
ZINC02146085
ZINC2146085
Check stock
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Check stock on Vitas-MAvailable files
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