Vitas-M small molecule compound
N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-chloro-7-nitro-1-benzothiophene-2-carboxamide
Catalog ID
STK588918
SMILES O=C(c1sc2c(c1Cl)cccc2[N+](=O)[O-])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 C17H12ClN3O4S2 MW 421.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O4S2/c18-12-8-4-1-5-9(21(24)25)13(8)27-14(12)16(23)20-17-11(15(19)22)7-3-2-6-10(7)26-17/h1,4-5H,2-3,6H2,(H2,19,22)(H,20,23)InChIKey
IYJMJHYKUMXWSY-UHFFFAOYSA-NSynonyms
879471-84-8879471848
C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(C4=C(S3)C(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC17H12ClN3O4S2c181284159(21(24)25)13(8)2714(12)16(23)201711(15(19)22)732610(7)2617h145H236H2(H21922)(H2023)
MFCD06594860
N(3CARBAMOYL56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)3CHLORO7NITRO1BENZOTHIOPHENE2CARBOXAMIDE
N(3carbamoyl56dihydro4Hcyclopenta(b)thiophen2yl)3chloro7nitrobenzo(b)thiophene2carboxamide
O=C(c1sc2c(c1Cl)cccc2(N+)(=O)(O))Nc1sc2c(c1C(=O)N)CCC2
ZINC000002197052
ZINC02197052
ZINC2197052
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