Vitas-M small molecule compound
(2E)-4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-4-oxobut-2-enoic acid
Catalog ID
STK328432
SMILES OC(=O)/C=C/C(=O)N1CCN(CC1)c1nc2c(s1)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 C15H15N3O3S MW 317.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O3S/c19-13(5-6-14(20)21)17-7-9-18(10-8-17)15-16-11-3-1-2-4-12(11)22-15/h1-6H,7-10H2,(H,20,21)/b6-5+InChIKey
MDNCHNIZLGPSDS-AATRIKPKSA-NSynonyms
(2E)4(4(13benzothiazol2yl)piperazin1yl)4oxobut2enoicacid
(E)4(4(13benzothiazol2yl)piperazin1yl)4oxobut2enoicacid
C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C=CC(=O)O
InChI=1SC15H15N3O3Sc1913(5614(20)21)177918(10817)151611312412(11)2215h16H710H2(H2021)b65+
MFCD06164637
OC(=O)C=CC(=O)N1CCN(CC1)c1nc2c(s1)cccc2
ZINC000018190987
ZINC18190987
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