(1-ethylbenzotriazol-5-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (1-ethylbenzotriazol-5-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-ethylbenzotriazol-5-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (1-ethyl-5-benzotriazolyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (1-ethylbenzotriazol-5-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-ethylbenzotriazol-5-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4)N=N1

InChI

InChI=1S/C17H19N5O3S2/c1-2-22-15-6-5-13(12-14(15)18-19-22)17(23)20-7-9-21(10-8-20)27(24,25)16-4-3-11-26-16/h3-6,11-12H,2,7-10H2,1H3