Vitas-M small molecule compound
2-methyl-1-oxo-3-phenyl-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STK935193
SMILES CC(c1n[nH]/c(=N/C(=O)C2c3ccccc3C(=O)N(C2c2ccccc2)C)/s1)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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-13(2)20-24-25-22(29-20)23-19(27)17-15-11-7-8-12-16(15)21(28)26(3)18(17)14-9-5-4-6-10-14/h4-13,17-18H,1-3H3,(H,23,25,27)InChIKey
TUBJZFONVFQHQJ-UHFFFAOYSA-NSynonyms
1190283-53-41190283534
2methyl1oxo3phenylN((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)1234tetrahydroisoquinoline4carboxamide
2methyl1oxo3phenylN(5propan2yl134thiadiazol2yl)34dihydroisoquinoline4carboxamide
CC(C)C1=NN=C(S1)NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC=CC=C4
CC(c1n(nH)c(=NC(=O)C2c3ccccc3C(=O)N(C2c2ccccc2)C)s1)C
InChI=1SC22H22N4O2Sc113(2)20242522(2920)2319(27)171511781216(15)21(28)26(3)18(17)1495461014h4131718H13H3(H232527)
MFCD18178002
ZINC000036358557
ZINC000036358560
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