3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzamide Openeye Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]benzamide CAS Name: 3-[(3-oxo-1-piperazinyl)sulfonyl]-N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]benzamide IUPAC Name: 3-(3-oxopiperazin-1-yl)sulfonyl-N-[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-[6-(1,2,4-triazol-1-yl)-3-pyridyl]benzamide Formula: C18H17N7O4S MolecularWeight: 427.43708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CN=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CN=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C18H17N7O4S/c26-17-10-24(7-6-20-17)30(28,29)15-3-1-2-13(8-15)18(27)23-14-4-5-16(21-9-14)25-12-19-11-22-25/h1-5,8-9,11-12H,6-7,10H2,(H,20,26)(H,23,27)