Vitas-M small molecule compound
N~2~-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-N-(4-methoxybenzyl)-L-alaninamide
Catalog ID
STK931447
SMILES COc1ccc(cc1)CNC(=O)[C@@H](NC(=O)NC1CCS(=O)(=O)C1)C
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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 C16H23N3O5S MW 369.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O5S/c1-11(18-16(21)19-13-7-8-25(22,23)10-13)15(20)17-9-12-3-5-14(24-2)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H,17,20)(H2,18,19,21)/t11-,13?/m0/s1InChIKey
PMCUCCIJXYGTTE-AMGKYWFPSA-NSynonyms
1214622-76-0(2S)2((11dioxothiolan3yl)carbamoylamino)N((4methoxyphenyl)methyl)propanamide
(2S)2(3(11dioxidotetrahydrothiophen3yl)ureido)N(4methoxybenzyl)propanamide
1214622760
CC(C(=O)NCC1=CC=C(C=C1)OC)NC(=O)NC2CCS(=O)(=O)C2
COc1ccc(cc1)CNC(=O)(C@@H)(NC(=O)NC1CCS(=O)(=O)C1)C
InChI=1SC16H23N3O5Sc111(1816(21)19137825(2223)1013)15(20)179123514(242)6412h361113H710H212H3(H1720)(H2181921)t1113?m0s1
MFCD18176952
N~2~((11dioxidotetrahydrothiophen3yl)carbamoyl)N(4methoxybenzyl)Lalaninamide
N2((11DIOXIDOTETRAHYDROTHIOPHEN3YL)CARBAMOYL)N(4METHOXYBENZYL)LALANINAMIDE
ZINC000036358527
ZINC000036358528
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