(1-ethylbenzotriazol-5-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (1-ethylbenzotriazol-5-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone Openeye Name: (1-ethylbenzotriazol-5-yl)-[4-[(5-phenyl-2-thienyl)methyl]piperazin-1-yl]methanone CAS Name: (1-ethyl-5-benzotriazolyl)-[4-[(5-phenyl-2-thiophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (1-ethylbenzotriazol-5-yl)-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]methanone Traditional Name: (1-ethylbenzotriazol-5-yl)-[4-[(5-phenyl-2-thienyl)methyl]piperazino]methanone Formula: C24H25N5OS MolecularWeight: 431.5532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC=C(S4)C5=CC=CC=C5)N=N1

InChI

InChI=1S/C24H25N5OS/c1-2-29-22-10-8-19(16-21(22)25-26-29)24(30)28-14-12-27(13-15-28)17-20-9-11-23(31-20)18-6-4-3-5-7-18/h3-11,16H,2,12-15,17H2,1H3