Vitas-M small molecule compound

N-[2-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]naphthalene-1-carboxamide

Catalog ID
STK757981
SMILES O=C(Nc1cc(Cl)ccc1C)CSc1sc2c(n1)ccc(c2)NC(=O)c1cccc2c1cccc2

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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 C27H20ClN3O2S2 MW 518.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN3O2S2/c1-16-9-10-18(28)13-23(16)30-25(32)15-34-27-31-22-12-11-19(14-24(22)35-27)29-26(33)21-8-4-6-17-5-2-3-7-20(17)21/h2-14H,15H2,1H3,(H,29,33)(H,30,32)
InChIKey
PBEQYIKRKJZXQX-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54
InChI=1SC27H20ClN3O2S2c11691018(28)1323(16)3025(32)1534273122121119(1424(22)3527)2926(33)2184617523720(17)21h214H15H21H3(H2933)(H3032)
MFCD01305333
N(2((2((5chloro2methylphenyl)amino)2oxoethyl)sulfanyl)13benzothiazol6yl)naphthalene1carboxamide
N(2(2(5CHLORO2METHYLANILINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)NAPHTHALENE1CARBOXAMIDE
ZINC000003666137
ZINC03666137
ZINC3666137

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Available files

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