Vitas-M small molecule compound
N-(3-acetylphenyl)-4-[2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)ethyl]piperazine-1-carbothioamide
Catalog ID
STK807347
SMILES S=C(N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)Nc1cccc(c1)C(=O)C
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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 C27H26N4O3S MW 486.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O3S/c1-18(32)20-7-2-8-21(17-20)28-27(35)30-14-11-29(12-15-30)13-16-31-25(33)22-9-3-5-19-6-4-10-23(24(19)22)26(31)34/h2-10,17H,11-16H2,1H3,(H,28,35)InChIKey
GSHLDIKASFIRQT-UHFFFAOYSA-NSynonyms
637320-49-1637320491
CC(=O)C1=CC(=CC=C1)NC(=S)N2CCN(CC2)CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O
InChI=1SC27H26N4O3Sc118(32)2072821(1720)2827(35)30141129(121530)13163125(33)2293519641023(24(19)22)26(31)34h21017H1116H21H3(H2835)
MFCD04219300
N(3ACETYLPHENYL)4(2(13DIOXO1HBENZO(DE)ISOQUINOLIN2(3H)YL)ETHYL)1PIPERAZINECARBOTHIOAMIDE
N(3acetylphenyl)4(2(13dioxo1Hbenzo(de)isoquinolin2(3H)yl)ethyl)piperazine1carbothioamide
N(3ACETYLPHENYL)4(2(13DIOXOBENZO(DE)ISOQUINOLIN2YL)ETHYL)PIPERAZINE1CARBOTHIOAMIDE
ZINC000020351569
ZINC20351569
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