Vitas-M small molecule compound

N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide

Catalog ID
STK625988
SMILES CCn1cc(C(=O)/N=c/2\sc3c([nH]2)cccc3)c(=O)c2c1cc1OCOc1c2

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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 C20H15N3O4S MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O4S/c1-2-23-9-12(18(24)11-7-15-16(8-14(11)23)27-10-26-15)19(25)22-20-21-13-5-3-4-6-17(13)28-20/h3-9H,2,10H2,1H3,(H,21,22,25)
InChIKey
YCYPKIXAWUCSOI-UHFFFAOYSA-N
Synonyms
951973-07-2
951973072
CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)NC4=NC5=CC=CC=C5S4
CCn1cc(C(=O)N=c2sc3c((nH)2)cccc3)c(=O)c2c1cc1OCOc1c2
InChI=1SC20H15N3O4Sc1223912(18(24)1171516(814(11)23)27102615)19(25)22202113534617(13)2820h39H210H21H3(H212225)
MFCD18159143
N((2Z)13benzothiazol2(3H)ylidene)5ethyl8oxo58dihydro(13)dioxolo(45g)quinoline7carboxamide
N(13benzothiazol2yl)5ethyl8oxo(13)dioxolo(45g)quinoline7carboxamide
ZINC000013735032
ZINC13735032

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Available files

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