N-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-[3-(3-oxidanylidenepiperazin-1-yl)sulfonylphenyl]-3-(1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-[3-(3-oxopiperazin-1-yl)sulfonylphenyl]-3-(tetrazol-1-yl)benzamide CAS Name: N-[3-[(3-oxo-1-piperazinyl)sulfonyl]phenyl]-3-(1-tetrazolyl)benzamide IUPAC Name: N-[3-(3-oxopiperazin-1-yl)sulfonylphenyl]-3-(tetrazol-1-yl)benzamide Traditional Name: N-[3-(3-ketopiperazino)sulfonylphenyl]-3-(tetrazol-1-yl)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)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)N4C=NN=N4

InChI

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