2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[4-(1,3-benzoxazol-2-yl)-1-piperidyl]methyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole-3-thione CAS Name: 2-[[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]methyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]methyl]-4-cyclopropyl-5-propan-2-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[4-(1,3-benzoxazol-2-yl)piperidino]methyl]-4-cyclopropyl-5-isopropyl-1,2,4-triazole-3-thione Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=S)N1C2CC2)CN3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC(C)C1=NN(C(=S)N1C2CC2)CN3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H27N5OS/c1-14(2)19-23-25(21(28)26(19)16-7-8-16)13-24-11-9-15(10-12-24)20-22-17-5-3-4-6-18(17)27-20/h3-6,14-16H,7-13H2,1-2H3