Vitas-M small molecule compound

{4-[4-nitro-3-(prop-2-en-1-ylamino)phenyl]piperazin-1-yl}(thiophen-2-yl)methanone

Catalog ID
STK206039
SMILES C=CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cccs1

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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 C18H20N4O3S MW 372.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3S/c1-2-7-19-15-13-14(5-6-16(15)22(24)25)20-8-10-21(11-9-20)18(23)17-4-3-12-26-17/h2-6,12-13,19H,1,7-11H2
InChIKey
VEBDRVNULDZADE-UHFFFAOYSA-N
Synonyms

(4(4NITRO3(PROP2EN1YLAMINO)PHENYL)PIPERAZIN1YL)(THIOPHEN2YL)METHANONE
(4(4NITRO3(PROP2ENYLAMINO)PHENYL)PIPERAZIN1YL)THIOPHEN2YLMETHANONE
C=CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=CS3)(N+)(=O)(O)
C=CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccs1
InChI=1SC18H20N4O3Sc12719151314(5616(15)22(24)25)2081021(11920)18(23)1743122617h26121319H1711H2
MFCD06182190
ZINC000004740958
ZINC04740958
ZINC4740958

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Available files

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