Vitas-M small molecule compound

N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1,3-benzodioxole-5-carboxamide

Catalog ID
STK245139
SMILES O=C(c1ccc2c(c1)OCO2)Nc1nnc(s1)CSc1ccccc1

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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 C17H13N3O3S2 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O3S2/c21-16(11-6-7-13-14(8-11)23-10-22-13)18-17-20-19-15(25-17)9-24-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,18,20,21)
InChIKey
OYCLJSPGQULDGN-UHFFFAOYSA-N
Synonyms
892696-79-6
2HBENZO(34D)13DIOXOLEN5YLN(5(PHENYLTHIOMETHYL)(134THIADIAZOL2YL))CARBOXAMIDE
892696796
C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NN=C(S3)CSC4=CC=CC=C4
InChI=1SC17H13N3O3S2c2116(11671314(811)23102213)1817201915(2517)924124213512h18H910H2(H182021)
MFCD07151199
N(5((phenylsulfanyl)methyl)134thiadiazol2yl)13benzodioxole5carboxamide
N(5(phenylsulfanylmethyl)134thiadiazol2yl)13benzodioxole5carboxamide
ZINC000009667423
ZINC09667423
ZINC9667423

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Available files

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