Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylamino)-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one

Catalog ID
STK167360
SMILES Cc1ccc(cc1)C1N=C(Nc2nc3c(s2)cccc3)NC2=C1C(=O)CCC2

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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 C22H20N4OS MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4OS/c1-13-9-11-14(12-10-13)20-19-16(6-4-7-17(19)27)23-21(25-20)26-22-24-15-5-2-3-8-18(15)28-22/h2-3,5,8-12,20H,4,6-7H2,1H3,(H2,23,24,25,26)
InChIKey
LEBDOVIYRRYSPU-UHFFFAOYSA-N
Synonyms
669718-44-9
2(13benzothiazol2ylamino)4(4methylphenyl)4678tetrahydro1Hquinazolin5one
2(13benzothiazol2ylamino)4(4methylphenyl)4678tetrahydroquinazolin5(1H)one
2(benzo(d)thiazol2ylamino)4(ptolyl)4678tetrahydroquinazolin5(1H)one
669718449
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=N2)NC4=NC5=CC=CC=C5S4
InChI=1SC22H20N4OSc11391114(121013)201916(64717(19)27)2321(2520)26222415523818(15)2822h23581220H467H21H3(H223242526)
MFCD04188211
ZINC000005900200
ZINC000005900224

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Available files

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