EMOLECULES 31217473

CAS No.
CCD No.
CCD03282426
Formula
C9 H12 N4 O4 S
MolWeight
272.284

Basic Information

Product Name: EMOLECULES 31217473
English Synonyms: EMOLECULES 31217473
MDL Number.: MFCD17010738
H bond acceptor: 8
H bond donor: 3
Smile: C(CSC(CC(=O)/C=N/NC(=O)N)C#N)C(=O)O
InChi: InChI=1S/C9H12N4O4S/c10-4-7(18-2-1-8(15)16)3-6(14)5-12-13-9(11)17/h5,7H,1-3H2,(H,15,16)(H3,11,13,17)/b12-5+
InChiKey: InChIKey=XNAMNUWOGOVTBO-LFYBBSHMSA-N

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