Vitas-M small molecule compound
2-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Catalog ID
STK355763
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1sc2c(c1C(=O)N)CCC2
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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 C18H18N4O5S2 MW 434.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5S2/c1-2-27-12-7-6-9(8-11(12)22(25)26)16(24)20-18(28)21-17-14(15(19)23)10-4-3-5-13(10)29-17/h6-8H,2-5H2,1H3,(H2,19,23)(H2,20,21,24,28)InChIKey
IXNMQRVDJVTALB-UHFFFAOYSA-NSynonyms
2((((4ethoxy3nitrophenyl)carbonyl)carbamothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxamide
2((((4ETHOXY3NITROPHENYL)CARBONYLAMINO)THIOXOMETHYL)AMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXAMIDE
2((4ETHOXY3NITROBENZOYL)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCC3)C(=O)N)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1sc2c(c1C(=O)N)CCC2
InChI=1SC18H18N4O5S2c122712769(811(12)22(25)26)16(24)2018(28)211714(15(19)23)1043513(10)2917h68H25H21H3(H21923)(H220212428)
MFCD04095914
ZINC000016692994
ZINC16692994
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