Vitas-M small molecule compound
(2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-N-(3-methoxyphenyl)ethanethioamide
Catalog ID
STK591623
SMILES COc1cccc(c1)NC(=S)/C=C/1\NCCc2c1cc1OCOc1c2
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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 C19H18N2O3S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S/c1-22-14-4-2-3-13(8-14)21-19(25)10-16-15-9-18-17(23-11-24-18)7-12(15)5-6-20-16/h2-4,7-10,20H,5-6,11H2,1H3,(H,21,25)/b16-10-InChIKey
HEAJVVMSSCUYTN-YBEGLDIGSA-NSynonyms
883951-61-9(2Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)N(3methoxyphenyl)ethanethioamide
(2Z)2(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)N(3methoxyphenyl)ethanethioamide
(Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)N(3methoxyphenyl)ethanethioamide
883951619
COC1=CC=CC(=C1)NC(=S)C=C2C3=CC4=C(C=C3CCN2)OCO4
COc1cccc(c1)NC(=S)C=C1NCCc2c1cc1OCOc1c2
InChI=1SC19H18N2O3Sc1221442313(814)2119(25)10161591817(23112418)712(15)562016h2471020H5611H21H3(H2125)b1610
MFCD07637965
ZINC000101366939
ZINC101366939
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