Vitas-M small molecule compound
N-[(4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)carbonothioyl]thiophene-2-carboxamide
Catalog ID
STK148770
SMILES S=C(N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[N+](=O)[O-])NC(=O)c1cccs1
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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 C21H21N5O4S2 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4S2/c27-20(19-4-2-12-32-19)23-21(31)25-9-7-24(8-10-25)15-5-6-18(26(28)29)17(13-15)22-14-16-3-1-11-30-16/h1-6,11-13,22H,7-10,14H2,(H,23,27,31)InChIKey
RYXFYCBJJWQDLX-UHFFFAOYSA-NSynonyms
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CO3)C(=S)NC(=O)C4=CC=CS4
InChI=1SC21H21N5O4S2c2720(1942123219)2321(31)259724(81025)155618(26(28)29)17(1315)22141631113016h16111322H71014H2(H232731)
MFCD02628102
N((4(3((FURAN2YLMETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)THIOPHENE2CARBOXAMIDE
N(4(3((furan2ylmethyl)amino)4nitrophenyl)piperazine1carbonothioyl)thiophene2carboxamide
N(4(3(FURAN2YLMETHYLAMINO)4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)THIOPHENE2CARBOXAMIDE
S=C(N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)(N+)(=O)(O))NC(=O)c1cccs1
ZINC000008660968
ZINC08660968
ZINC8660968
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