Vitas-M small molecule compound
2-{[(3,4-dimethoxyphenyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Catalog ID
STK427602
SMILES COc1ccc(cc1OC)CC(=O)Nc1sc2c(c1C(=O)N)CCCCCC2
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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 C21H26N2O4S MW 402.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4S/c1-26-15-10-9-13(11-16(15)27-2)12-18(24)23-21-19(20(22)25)14-7-5-3-4-6-8-17(14)28-21/h9-11H,3-8,12H2,1-2H3,(H2,22,25)(H,23,24)InChIKey
KKVOYSGKOBOAKX-UHFFFAOYSA-NSynonyms
2(((34dimethoxyphenyl)acetyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2((2(34dimethoxyphenyl)acetyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
COC1=C(C=C(C=C1)CC(=O)NC2=C(C3=C(S2)CCCCCC3)C(=O)N)OC
InChI=1SC21H26N2O4Sc1261510913(1116(15)272)1218(24)232119(20(22)25)1475346817(14)2821h911H3812H212H3(H22225)(H2324)
MFCD01358696
ZINC000001217336
ZINC01217336
ZINC1217336
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