3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS No.
531542-13-9
CCD No.
CCD00396451
Formula
C19 H18 I2 N2 O4 S
MolWeight
624.227

Basic Information

Product Name: 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 531542-13-9
English Synonyms: 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID ; BENZOIC ACID, 3,5-DIIODO-2-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-
MDL Number.: MFCD03567271
H bond acceptor: 6
H bond donor: 3
Smile: CC(C)COc1ccc(cc1)C(=O)NC(=S)Nc2c(cc(cc2I)I)C(=O)O
InChi: InChI=1S/C19H18I2N2O4S/c1-10(2)9-27-13-5-3-11(4-6-13)17(24)23-19(28)22-16-14(18(25)26)7-12(20)8-15(16)21/h3-8,10H,9H2,1-2H3,(H,25,26)(H2,22,23,24,28)
InChiKey: InChIKey=VQRLROUMGQSXHW-UHFFFAOYSA-N

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