Vitas-M small molecule compound

1-(1,3-benzoxazol-2-ylsulfanyl)-4-(4-chlorophenyl)phthalazine

Catalog ID
STK053680
SMILES Clc1ccc(cc1)c1nnc(c2c1cccc2)Sc1nc2c(o1)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 C21H12ClN3OS MW 389.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12ClN3OS/c22-14-11-9-13(10-12-14)19-15-5-1-2-6-16(15)20(25-24-19)27-21-23-17-7-3-4-8-18(17)26-21/h1-12H
InChIKey
SBWILTSWVMTIGK-UHFFFAOYSA-N
Synonyms
352326-58-0
1(13BENZOXAZOL2YLSULFANYL)4(4CHLOROPHENYL)PHTHALAZINE
1(13BENZOXAZOL2YLTHIO)4(4CHLOROPHENYL)PHTHALAZINE
2((4(4chlorophenyl)phthalazin1yl)thio)benzo(d)oxazole
2(4(4CHLOROPHENYL)PHTHALAZIN1YL)SULFANYL13BENZOXAZOLE
2(4(4CHLOROPHENYL)PHTHALAZINYLTHIO)BENZOXAZOLE
352326580
C1=CC=C2C(=C1)C(=NN=C2SC3=NC4=CC=CC=C4O3)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)c1nnc(c2c1cccc2)Sc1nc2c(o1)cccc2
InChI=1SC21H12ClN3OSc221411913(101214)1915512616(15)20(252419)27212317734818(17)2621h112H
MFCD01951375
STK053680
ZINC000002283368
ZINC02283368
ZINC2283368

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.