Vitas-M small molecule compound
2-nitro-N-[(2-{[4-(pentanoylamino)phenyl]carbonyl}hydrazinyl)carbonothioyl]benzamide
Catalog ID
STL064047
SMILES CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccccc1[N+](=O)[O-]
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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 C20H21N5O5S MW 443.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O5S/c1-2-3-8-17(26)21-14-11-9-13(10-12-14)18(27)23-24-20(31)22-19(28)15-6-4-5-7-16(15)25(29)30/h4-7,9-12H,2-3,8H2,1H3,(H,21,26)(H,23,27)(H2,22,24,28,31)InChIKey
QQAJGYAAOPZRPR-UHFFFAOYSA-NSynonyms
2NITRON(((4(PENTANOYLAMINO)BENZOYL)AMINO)CARBAMOTHIOYL)BENZAMIDE
2nitroN((2((4(pentanoylamino)phenyl)carbonyl)hydrazinyl)carbonothioyl)benzamide
2NITRON((2(4(PENTANOYLAMINO)BENZOYL)HYDRAZINO)CARBONOTHIOYL)BENZAMIDE
CCCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2(N+)(=O)(O)
CCCCC(=O)Nc1ccc(cc1)C(=O)NNC(=S)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC20H21N5O5Sc123817(26)211411913(101214)18(27)232420(31)2219(28)15645716(15)25(29)30h47912H238H21H3(H2126)(H2327)(H222242831)
MFCD05055108
ZINC000012292089
ZINC12292089
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