Vitas-M small molecule compound
N-[(4-butoxybenzyl)(2-cyanoethyl)carbamothioyl]benzamide
Catalog ID
STK833411
SMILES CCCCOc1ccc(cc1)CN(C(=S)NC(=O)c1ccccc1)CCC#N
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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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c1-2-3-16-27-20-12-10-18(11-13-20)17-25(15-7-14-23)22(28)24-21(26)19-8-5-4-6-9-19/h4-6,8-13H,2-3,7,15-17H2,1H3,(H,24,26,28)InChIKey
GUHIBNZAPZWUKQ-UHFFFAOYSA-NSynonyms
55383-85-23BENZOYL1(4BUTOXYBENZYL)1(2CYANOETHYL)THIOUREA
55383852
CCCCOC1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C2=CC=CC=C2
InChI=1SC22H25N3O2Sc123162720121018(111320)1725(1571423)22(28)2421(26)198546919h46813H2371517H21H3(H242628)
MFCD00698328
N((((4BUTOXYPHENYL)METHYL)(2CYANOETHYL)AMINO)THIOXOMETHYL)BENZAMIDE
N((4butoxybenzyl)(2cyanoethyl)carbamothioyl)benzamide
N((4BUTOXYPHENYL)METHYL(2CYANOETHYL)CARBAMOTHIOYL)BENZAMIDE
ZINC000002351080
ZINC02351080
ZINC2351080
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