Vitas-M small molecule compound

2-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]hydrazinecarbothioamide

Catalog ID
STK458536
SMILES COc1cc(CCNC(=S)NNC(=O)C(Sc2nc3c(s2)cccc3)C)ccc1OC

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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 C21H24N4O3S3 MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S3/c1-13(30-21-23-15-6-4-5-7-18(15)31-21)19(26)24-25-20(29)22-11-10-14-8-9-16(27-2)17(12-14)28-3/h4-9,12-13H,10-11H2,1-3H3,(H,24,26)(H2,22,25,29)
InChIKey
HTQRESRSPUUIBZ-UHFFFAOYSA-N
Synonyms

1(2(13BENZOTHIAZOL2YLSULFANYL)PROPANOYLAMINO)3(2(34DIMETHOXYPHENYL)ETHYL)THIOUREA
2((2R)2(13BENZOTHIAZOL2YLSULFANYL)PROPANOYL)N(2(34DIMETHOXYPHENYL)ETHYL)HYDRAZINECARBOTHIOAMIDE
2(2(13benzothiazol2ylsulfanyl)propanoyl)N(2(34dimethoxyphenyl)ethyl)hydrazinecarbothioamide
2BENZOTHIAZOL2YLTHION((((2(34DIMETHOXYPHENYL)ETHYL)AMINO)THIOXOMETHYL)AMINO)PROPANAMIDE
CC(C(=O)NNC(=S)NCCC1=CC(=C(C=C1)OC)OC)SC2=NC3=CC=CC=C3S2
InChI=1SC21H24N4O3S3c113(30212315645718(15)3121)19(26)242520(29)221110148916(272)17(1214)283h491213H1011H213H3(H2426)(H2222529)
MFCD05122586
ZINC000002856261
ZINC000002856262

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Available files

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