6-chloranyl-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 6-chloranyl-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione Openeye Name: 6-chloro-3-[[4-(4-pyridylmethyl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione CAS Name: 6-chloro-3-[[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]-1,3-benzoxazole-2-thione IUPAC Name: 6-chloro-3-[[4-(pyridin-4-ylmethyl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione Traditional Name: 6-chloro-3-[[4-(4-pyridylmethyl)piperazino]methyl]-1,3-benzoxazole-2-thione Formula: C18H19ClN4OS MolecularWeight: 374.88766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)CN3C4=C(C=C(C=C4)Cl)OC3=S

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)CN3C4=C(C=C(C=C4)Cl)OC3=S

InChI

InChI=1S/C18H19ClN4OS/c19-15-1-2-16-17(11-15)24-18(25)23(16)13-22-9-7-21(8-10-22)12-14-3-5-20-6-4-14/h1-6,11H,7-10,12-13H2