Vitas-M small molecule compound
(2E)-N-[(4-bromophenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STK155688
SMILES O=C(NC(=S)Nc1ccc(cc1)Br)/C=C/c1cccc(c1)[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 C16H12BrN3O3S MW 406.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrN3O3S/c17-12-5-7-13(8-6-12)18-16(24)19-15(21)9-4-11-2-1-3-14(10-11)20(22)23/h1-10H,(H2,18,19,21,24)/b9-4+InChIKey
XHINRRDFSTZYBF-RUDMXATFSA-NSynonyms
(2E)N(((4BROMOPHENYL)AMINO)THIOXOMETHYL)3(3NITROPHENYL)PROP2ENAMIDE
(2E)N((4BROMOPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
(E)N((4BROMOPHENYL)CARBAMOTHIOYL)3(3NITROPHENYL)PROP2ENAMIDE
C1=CC(=CC(=C1)(N+)(=O)(O))C=CC(=O)NC(=S)NC2=CC=C(C=C2)Br
InChI=1SC16H12BrN3O3Sc17125713(8612)1816(24)1915(21)941121314(1011)20(22)23h110H(H218192124)b94+
MFCD03549227
O=C(NC(=S)Nc1ccc(cc1)Br)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000004688079
ZINC04688079
ZINC4688079
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