3,5-DIBROMO-2-[[[[3-(1-METHYLETHOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS No.
535948-69-7
CCD No.
CCD00397019
Formula
C18 H16 Br2 N2 O4 S
MolWeight
516.208

Basic Information

Product Name: 3,5-DIBROMO-2-[[[[3-(1-METHYLETHOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 535948-69-7
English Synonyms: BENZOIC ACID, 3,5-DIBROMO-2-[[[[3-(1-METHYLETHOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]- ; 3,5-DIBROMO-2-[[[[3-(1-METHYLETHOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
MDL Number.: MFCD03572082
H bond acceptor: 6
H bond donor: 3
Smile: CC(C)Oc1cccc(c1)C(=O)NC(=S)Nc2c(cc(cc2Br)Br)C(=O)O
InChi: InChI=1S/C18H16Br2N2O4S/c1-9(2)26-12-5-3-4-10(6-12)16(23)22-18(27)21-15-13(17(24)25)7-11(19)8-14(15)20/h3-9H,1-2H3,(H,24,25)(H2,21,22,23,27)
InChiKey: InChIKey=MBIRJYQCZWGJFI-UHFFFAOYSA-N

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