Vitas-M small molecule compound
N-{1-[(2E)-1,3-benzothiazol-2(3H)-ylideneamino]-1-oxopropan-2-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Catalog ID
STK642449
SMILES O=C(C1COc2c(O1)cccc2)NC(C(=O)/N=c\1/sc2c([nH]1)cccc2)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 C19H17N3O4S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O4S/c1-11(17(23)22-19-21-12-6-2-5-9-16(12)27-19)20-18(24)15-10-25-13-7-3-4-8-14(13)26-15/h2-9,11,15H,10H2,1H3,(H,20,24)(H,21,22,23)InChIKey
GCCKWVUHTQGALA-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=NC2=CC=CC=C2S1)NC(=O)C3COC4=CC=CC=C4O3
InChI=1SC19H17N3O4Sc111(17(23)22192112625916(12)2719)2018(24)15102513734814(13)2615h291115H10H21H3(H2024)(H212223)
MFCD18162984
N(1((2E)13benzothiazol2(3H)ylideneamino)1oxopropan2yl)23dihydro14benzodioxine2carboxamide
N(1(13benzothiazol2ylamino)1oxopropan2yl)23dihydro14benzodioxine3carboxamide
O=C(C1COc2c(O1)cccc2)NC(C(=O)N=c1sc2c((nH)1)cccc2)C
ZINC000012409699
ZINC000036569671
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