Vitas-M small molecule compound
3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-(4-oxo-2-sulfanylquinazolin-3(4H)-yl)propanamide
Catalog ID
STK306044
SMILES O=C(Nn1c(S)nc2c(c1=O)cccc2)CCn1cnc(n1)[N+](=O)[O-]
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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 C13H11N7O4S MW 361.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N7O4S/c21-10(5-6-18-7-14-12(17-18)20(23)24)16-19-11(22)8-3-1-2-4-9(8)15-13(19)25/h1-4,7H,5-6H2,(H,15,25)(H,16,21)InChIKey
NAZWGTCXWNTHPL-UHFFFAOYSA-NSynonyms
676522-84-23(3NITRO(124TRIAZOLYL))N(4OXO2SULFANYL(3HYDROQUINAZOLIN3YL))PROPANAMIDE
3(3NITRO124TRIAZOL1YL)N(4OXO2SULFANYLIDENE1HQUINAZOLIN3YL)PROPANAMIDE
3(3nitro1H124triazol1yl)N(4oxo2sulfanylquinazolin3(4H)yl)propanamide
676522842
C1=CC=C2C(=C1)C(=O)N(C(=S)N2)NC(=O)CCN3C=NC(=N3)(N+)(=O)(O)
InChI=1SC13H11N7O4Sc2110(561871412(1718)20(23)24)161911(22)831249(8)1513(19)25h147H56H2(H1525)(H1621)
MFCD04046670
O=C(Nn1c(S)nc2c(c1=O)cccc2)CCn1cnc(n1)(N+)(=O)(O)
ZINC000102002703
ZINC102002703
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