2-(1,3-diphenylpyrazol-4-yl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione

Systemtic Name: 2-(1,3-diphenylpyrazol-4-yl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione Openeye Name: 2-(1,3-diphenylpyrazol-4-yl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione CAS Name: 2-(1,3-diphenyl-4-pyrazolyl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione IUPAC Name: 2-(1,3-diphenylpyrazol-4-yl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione Traditional Name: 2-(1,3-diphenylpyrazol-4-yl)-5,6,7,8-tetrahydro-1,3-benzoxazine-4-thione Formula: C23H19N3OS MolecularWeight: 385.48146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=S)N=C(O2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=S)N=C(O2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H19N3OS/c28-23-18-13-7-8-14-20(18)27-22(24-23)19-15-26(17-11-5-2-6-12-17)25-21(19)16-9-3-1-4-10-16/h1-6,9-12,15H,7-8,13-14H2