Vitas-M small molecule compound
(1S,8aS)-4-amino-1-(thiophen-2-yl)-6,7,8,8a-tetrahydronaphthalene-2,2,3(1H)-tricarbonitrile
Catalog ID
STK534602
SMILES N#CC1=C(N)C2=CCCC[C@H]2[C@@H](C1(C#N)C#N)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 C17H14N4S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4S/c18-8-13-16(21)12-5-2-1-4-11(12)15(14-6-3-7-22-14)17(13,9-19)10-20/h3,5-7,11,15H,1-2,4,21H2/t11-,15-/m1/s1InChIKey
KLKSDIDELSZPPD-IAQYHMDHSA-NSynonyms
303177-11-9(1S8aS)4amino1(thiophen2yl)6788atetrahydronaphthalene223(1H)tricarbonitrile
(1S8aS)4amino1thiophen2yl6788atetrahydro1Hnaphthalene223tricarbonitrile
303177119
C1CC=C2C(C1)C(C(C(=C2N)C#N)(C#N)C#N)C3=CC=CS3
InChI=1SC17H14N4Sc1881316(21)12521411(12)15(146372214)17(13919)1020h3571115H12421H2t1115m1s1
N#CC1=C(N)C2=CCCC(C@H)2(C@@H)(C1(C#N)C#N)c1cccs1
ZINC000004730760
ZINC04730760
ZINC4730760
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