[3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-sulfanylidene-imidazol-1-yl]boron

Systemtic Name: [3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-sulfanylidene-imidazol-1-yl]boron Openeye Name: [3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-thioxo-imidazol-1-yl]boron CAS Name: [3-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-2-sulfanylidene-1-imidazolyl]boron IUPAC Name: [3-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2-sulfanylideneimidazol-1-yl]boron Traditional Name: [3-[4-[4-(2-methoxyphenyl)piperazino]butyl]-2-thioxo-4-imidazolin-1-yl]boron Formula: C18H25BN4OS MolecularWeight: 356.2933

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Descriptors Computed from Structure

Canonical SMILES:

[B]N1C=CN(C1=S)CCCCN2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

[B]N1C=CN(C1=S)CCCCN2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C18H25BN4OS/c1-24-17-7-3-2-6-16(17)21-12-10-20(11-13-21)8-4-5-9-22-14-15-23(19)18(22)25/h2-3,6-7,14-15H,4-5,8-13H2,1H3