2H-benzotriazol-5-yl-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2H-benzotriazol-5-yl-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2H-benzotriazol-5-yl-(4-benzylsulfonylpiperazin-1-yl)methanone CAS Name: 2H-benzotriazol-5-yl-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2H-benzotriazol-5-yl-(4-benzylsulfonylpiperazin-1-yl)methanone Traditional Name: 2H-benzotriazol-5-yl-(4-benzylsulfonylpiperazino)methanone Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=NNN=C3C=C2)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=NNN=C3C=C2)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C18H19N5O3S/c24-18(15-6-7-16-17(12-15)20-21-19-16)22-8-10-23(11-9-22)27(25,26)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,19,20,21)