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Details

Stereochemistry UNKNOWN
Molecular Formula C12H18N4O6S
Molecular Weight 346.36
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (DE(CHLORO)-((2-ACETAMIDO-2-CARBOXYETHYL)SULFANYL))-ORNIDAZOLE

SMILES

CC(=O)NC(CSCC(O)CN1C(C)=NC=C1[N+]([O-])=O)C(O)=O

InChI

InChIKey=QHKYXHXQRMXJIQ-UHFFFAOYSA-N
InChI=1S/C12H18N4O6S/c1-7-13-3-11(16(21)22)15(7)4-9(18)5-23-6-10(12(19)20)14-8(2)17/h3,9-10,18H,4-6H2,1-2H3,(H,14,17)(H,19,20)

HIDE SMILES / InChI

Molecular Formula C12H18N4O6S
Molecular Weight 346.36
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
DNT1PO1U8A
Record Status Validated (UNII)
Record Version