Vitas-M small molecule compound
N-[(2Z)-6-methoxy-1,3-benzothiazol-2(3H)-ylidene]-3-(4-methoxyphenyl)-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Catalog ID
STK942836
SMILES COc1ccc(cc1)C1C(C(=O)/N=c/2\sc3c([nH]2)ccc(c3)OC)c2ccccc2C(=O)N1C
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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 C26H23N3O4S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4S/c1-29-23(15-8-10-16(32-2)11-9-15)22(18-6-4-5-7-19(18)25(29)31)24(30)28-26-27-20-13-12-17(33-3)14-21(20)34-26/h4-14,22-23H,1-3H3,(H,27,28,30)InChIKey
HQYPNILTZPVLEW-UHFFFAOYSA-NSynonyms
442888-90-6442888906
CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)OC)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1C(C(=O)N=c2sc3c((nH)2)ccc(c3)OC)c2ccccc2C(=O)N1C
InChI=1SC26H23N3O4Sc12923(1581016(322)11915)22(18645719(18)25(29)31)24(30)28262720131217(333)1421(20)3426h4142223H13H3(H272830)
MFCD18180202
N((2Z)6methoxy13benzothiazol2(3H)ylidene)3(4methoxyphenyl)2methyl1oxo1234tetrahydroisoquinoline4carboxamide
N(6METHOXY13BENZOTHIAZOL2YL)3(4METHOXYPHENYL)2METHYL1OXO34DIHYDROISOQUINOLINE4CARBOXAMIDE
ZINC000003657626
ZINC000003657629
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