3-[[[[[5-(4-BROMOPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID

CAS No.
461402-58-4
CCD No.
CCD00369082
Formula
C19 H13 Br N2 O4 S
MolWeight
445.292

Basic Information

Product Name: 3-[[[[[5-(4-BROMOPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
CAS: 461402-58-4
English Synonyms: BENZOIC ACID, 3-[[[[[5-(4-BROMOPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]- ; 3-[[[[[5-(4-BROMOPHENYL)-2-FURANYL]CARBONYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
MDL Number.: MFCD03244429
H bond acceptor: 6
H bond donor: 3
Smile: c1cc(cc(c1)NC(=S)NC(=O)c2ccc(o2)c3ccc(cc3)Br)C(=O)O
InChi: InChI=1S/C19H13BrN2O4S/c20-13-6-4-11(5-7-13)15-8-9-16(26-15)17(23)22-19(27)21-14-3-1-2-12(10-14)18(24)25/h1-10H,(H,24,25)(H2,21,22,23,27)
InChiKey: InChIKey=VFDFLLHJYRZBAK-UHFFFAOYSA-N

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