Basic Information |
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Product Name: | 5-CHLORO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID |
CAS: | 586392-43-0 |
English Synonyms: | 5-CHLORO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 5-CHLORO-2-[[[(3-METHYL-4-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]- |
MDL Number.: | MFCD03574683 |
H bond acceptor: | 8 |
H bond donor: | 3 |
Smile: | Cc1cc(ccc1[N+](=O)[O-])C(=O)NC(=S)Nc2ccc(cc2C(=O)O)Cl |
InChi: | InChI=1S/C16H12ClN3O5S/c1-8-6-9(2-5-13(8)20(24)25)14(21)19-16(26)18-12-4-3-10(17)7-11(12)15(22)23/h2-7H,1H3,(H,22,23)(H2,18,19,21,26) |
InChiKey: | InChIKey=OTTBTQSKBSJHLT-UHFFFAOYSA-N |
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