Vitas-M small molecule compound
N-[(2E)-6-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-1,3-benzothiazol-2(3H)-ylidene]methanesulfonamide
Catalog ID
STK641779
SMILES O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)N1CCc2c(C1)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 C18H17N3O3S2 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S2/c1-26(23,24)20-18-19-15-7-6-13(10-16(15)25-18)17(22)21-9-8-12-4-2-3-5-14(12)11-21/h2-7,10H,8-9,11H2,1H3,(H,19,20)InChIKey
UJKGKOZAEKJEAL-UHFFFAOYSA-NSynonyms
951958-54-6951958546
CS(=O)(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3
InChI=1SC18H17N3O3S2c126(2324)201819157613(1016(15)2518)17(22)219812423514(12)1121h2710H8911H21H3(H1920)
MFCD18162747
N((2E)6(34dihydroisoquinolin2(1H)ylcarbonyl)13benzothiazol2(3H)ylidene)methanesulfonamide
N(6(34dihydro1Hisoquinoline2carbonyl)13benzothiazol2yl)methanesulfonamide
O=C(c1ccc2c(c1)sc(=NS(=O)(=O)C)(nH)2)N1CCc2c(C1)cccc2
ZINC000013728004
ZINC13728004
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