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Details

Stereochemistry UNKNOWN
Molecular Formula C12H19ClN4O4S
Molecular Weight 350.822
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4((2-ACETAMIDO-2-CARBOXYETHYL)SULFANYL)-5-DE(NITRO)-5-AMINO-ORNIDAZOLE

SMILES

CC(=O)NC(CSC1=C(N)N(CC(O)CCl)C(C)=N1)C(O)=O

InChI

InChIKey=JRMOFEDRQOGARJ-UHFFFAOYSA-N
InChI=1S/C12H19ClN4O4S/c1-6-15-11(10(14)17(6)4-8(19)3-13)22-5-9(12(20)21)16-7(2)18/h8-9,19H,3-5,14H2,1-2H3,(H,16,18)(H,20,21)

HIDE SMILES / InChI

Molecular Formula C12H19ClN4O4S
Molecular Weight 350.822
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
EGC26P7H7Y
Record Status Validated (UNII)
Record Version