Vitas-M small molecule compound

(2E,5Z)-3-benzyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[5-oxo-1-phenyl-3-(phenylamino)-1,5-dihydro-4H-pyrazol-4-ylidene]-1,3-thiazolidin-4-one

Catalog ID
STK383552
SMILES Clc1ccc2c(c1)n(C)/c(=c\1/s/c(=C/3\C(=NN(C3=O)c3ccccc3)Nc3ccccc3)/n(c1=O)Cc1ccccc1)/s2

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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 C33H24ClN5O2S2 MW 622.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24ClN5O2S2/c1-37-25-19-22(34)17-18-26(25)42-33(37)28-31(41)38(20-21-11-5-2-6-12-21)32(43-28)27-29(35-23-13-7-3-8-14-23)36-39(30(27)40)24-15-9-4-10-16-24/h2-19H,20H2,1H3,(H,35,36)/b32-27+,33-28-
InChIKey
HSGQEWXAGLKJFA-QPNRKFHMSA-N
Synonyms

(2E5Z)2(3ANILINO5OXO1PHENYLPYRAZOL4YLIDENE)3BENZYL5(5CHLORO3METHYL13BENZOTHIAZOL2YLIDENE)13THIAZOLIDIN4ONE
(2E5Z)3benzyl5(5chloro3methyl13benzothiazol2(3H)ylidene)2(5oxo1phenyl3(phenylamino)15dihydro4Hpyrazol4ylidene)13thiazolidin4one
5(5CHLORO3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))2(5OXO1PHENYL3(PHENYLAMINO)(12DIAZOLIN4YLIDENE))3BENZYL13THIAZOLIDIN4ONE
Clc1ccc2c(c1)n(C)c(=c1sc(=C3C(=NN(C3=O)c3ccccc3)Nc3ccccc3)n(c1=O)Cc1ccccc1)s2
CN1C2=C(C=CC(=C2)Cl)SC1=C3C(=O)N(C(=C4C(=NN(C4=O)C5=CC=CC=C5)NC6=CC=CC=C6)S3)CC7=CC=CC=C7
InChI=1SC33H24ClN5O2S2c137251922(34)171826(25)4233(37)2831(41)38(2021115261221)32(4328)2729(3523137381423)3639(30(27)40)241594101624h219H20H21H3(H3536)b3227+3328
MFCD01077982
ZINC000102154638
ZINC102154638

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Available files

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