Vitas-M small molecule compound

4-amino-5-(1,3-benzodioxol-5-ylcarbonyl)-2-(propylamino)thiophene-3-carbonitrile

Catalog ID
STL156719
SMILES CCCNc1sc(c(c1C#N)N)C(=O)c1ccc2c(c1)OCO2

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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 C16H15N3O3S MW 329.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O3S/c1-2-5-19-16-10(7-17)13(18)15(23-16)14(20)9-3-4-11-12(6-9)22-8-21-11/h3-4,6,19H,2,5,8,18H2,1H3
InChIKey
DFCZHTMQTJPFTA-UHFFFAOYSA-N
Synonyms
1309182-41-9
1309182419
4amino5(13benzodioxol5ylcarbonyl)2(propylamino)thiophene3carbonitrile
4amino5(13benzodioxole5carbonyl)2(propylamino)thiophene3carbonitrile
4AMINO5(2HBENZO(D)13DIOXOLEN5YLCARBONYL)2(PROPYLAMINO)THIOPHENE3CARBONITRILE
4amino5(benzo(d)(13)dioxole5carbonyl)2(propylamino)thiophene3carbonitrile
CCCNC1=C(C(=C(S1)C(=O)C2=CC3=C(C=C2)OCO3)N)C#N
InChI=1SC16H15N3O3Sc125191610(717)13(18)15(2316)14(20)9341112(69)2282111h34619H25818H21H3
MFCD16555541
ZINC000067601963
ZINC67601963

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Available files

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