Vitas-M small molecule compound
4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)-N-[(2Z)-5-(propan-2-yl)-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Catalog ID
STK942019
SMILES O=C(/N=c\1/[nH]nc(s1)C(C)C)CCCn1nnc2c(c1=O)cccc2
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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 C16H18N6O2S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O2S/c1-10(2)14-19-20-16(25-14)17-13(23)8-5-9-22-15(24)11-6-3-4-7-12(11)18-21-22/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,17,20,23)InChIKey
ICJFEXIRQDWTHD-UHFFFAOYSA-NSynonyms
1219545-46-61219545466
4(4oxo123benzotriazin3(4H)yl)N((2Z)5(propan2yl)134thiadiazol2(3H)ylidene)butanamide
4(4oxo123benzotriazin3yl)N(5propan2yl134thiadiazol2yl)butanamide
CC(C)C1=NN=C(S1)NC(=O)CCCN2C(=O)C3=CC=CC=C3N=N2
InChI=1SC16H18N6O2Sc110(2)14192016(2514)1713(23)8592215(24)11634712(11)182122h346710H589H212H3(H172023)
MFCD18179964
O=C(N=c1(nH)nc(s1)C(C)C)CCCn1nnc2c(c1=O)cccc2
ZINC000040284532
ZINC40284532
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