Vitas-M small molecule compound
11-{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-7,8,9,10-tetrahydrobenzimidazo[1,2-b]isoquinoline-6-carbonitrile
Catalog ID
STK736749
SMILES C=CCn1c(nnc1Sc1c2CCCCc2c(c2n1c1ccccc1n2)C#N)Cc1ccccc1
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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 C28H24N6S MW 476.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N6S/c1-2-16-33-25(17-19-10-4-3-5-11-19)31-32-28(33)35-27-21-13-7-6-12-20(21)22(18-29)26-30-23-14-8-9-15-24(23)34(26)27/h2-5,8-11,14-15H,1,6-7,12-13,16-17H2InChIKey
BNRNNXHOVYPBTR-UHFFFAOYSA-NSynonyms
11((5benzyl4(prop2en1yl)4H124triazol3yl)sulfanyl)78910tetrahydrobenzimidazo(12b)isoquinoline6carbonitrile
11((5benzyl4prop2enyl124triazol3yl)sulfanyl)78910tetrahydrobenzimidazolo(12b)isoquinoline6carbonitrile
C=CCN1C(=NN=C1SC2=C3CCCCC3=C(C4=NC5=CC=CC=C5N24)C#N)CC6=CC=CC=C6
InChI=1SC28H24N6Sc12163325(1719104351119)313228(33)35272113761220(21)22(1829)26302314891524(23)34(26)27h258111415H16712131617H2
MFCD08142716
ZINC000012363703
ZINC12363703
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