Vitas-M small molecule compound
3-chloro-N-({2-[(4-nitrophenyl)amino]ethyl}carbamothioyl)benzamide
Catalog ID
STK174209
SMILES S=C(NC(=O)c1cccc(c1)Cl)NCCNc1ccc(cc1)[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 C16H15ClN4O3S MW 378.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O3S/c17-12-3-1-2-11(10-12)15(22)20-16(25)19-9-8-18-13-4-6-14(7-5-13)21(23)24/h1-7,10,18H,8-9H2,(H2,19,20,22,25)InChIKey
PIGLHOVVAZHSAF-UHFFFAOYSA-NSynonyms
3CHLORON((2((4NITROPHENYL)AMINO)ETHYL)CARBAMOTHIOYL)BENZAMIDE
3CHLORON(2(4NITROANILINO)ETHYLCARBAMOTHIOYL)BENZAMIDE
C1=CC(=CC(=C1)Cl)C(=O)NC(=S)NCCNC2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC16H15ClN4O3Sc171231211(1012)15(22)2016(25)199818134614(7513)21(23)24h171018H89H2(H219202225)
MFCD02628575
S=C(NC(=O)c1cccc(c1)Cl)NCCNc1ccc(cc1)(N+)(=O)(O)
ZINC000004703958
ZINC04703958
ZINC4703958
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